Chem
J-GLOBAL ID:200907049937223039   Nikkaji number:J1.840.777I

2-Chloro-7-[3,5-bis[3,5-bis[3,5-bis[3,5-di(tert-butyl)benzyloxy]benzyloxy]benzyloxy]benzylamino]-1,8-naphthyridine-3-carboxylic acid ethyl ester

2-クロロ-7-[3,5-ビス[3,5-ビス[3,5-ビス[3,5-ジ(tert-ブチル)ベンジルオキシ]ベンジルオキシ]ベンジルオキシ]ベンジルアミノ]-1,8-ナフチリジン-3-カルボン酸エチル
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C180H228ClN3O16
Molecular formula furigana: C180-H228-CL-N3-O16
Molecular weight: 2725.260
InChI: InChI=1S/C180H228ClN3O16/c1-50-186-164(185)160-83-129-51-52-161(183-163(129)184-162(160)181)182-99-114-69-146(195-108-123-79-156(197-110-125-71-148(187-100-115-53-130(165(2,3)4)84-131(54-115)166(5,6)7)93-149(72-125)188-101-116-55-132(167(8,9)10)85-133(56-116)168(11,12)13)97-157(80-123)198-111-126-73-150(189-102-117-57-134(169(14,15)16)86-135(58-117)170(17,18)19)94-151(74-126)190-103-118-59-136(171(20,21)22)87-137(60-118)172(23,24)25)92-147(70-114)196-109-124-81-158(199-112-127-75-152(191-104-119-61-138(173(26,27)28)88-139(62-119)174(29,30)31)95-153(76-127)192-105-120-63-140(175(32,33)34)89-141(64-120)176(35,36)37)98-159(82-124)200-113-128-77-154(193-106-121-65-142(177(38,39)40)90-143(66-121)178(41,42)43)96-155(78-128)194-107-122-67-144(179(44,45)46)91-145(68-122)180(47,48)49/h51-98H,50,99-113H2,1-49H3,(H,182,183,184)
InChI key: FGQWTTMKYPVXHK-UHFFFAOYSA-N
SMILES: CCOC(=O)c1cc2ccc(NCc3cc(OCc4cc(OCc5cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)c5)cc(OCc5cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)c5)c4)cc(OCc4cc(OCc5cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)c5)cc(OCc5cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)cc(OCc6cc(cc(c6)C(C)(C)C)C(C)(C)C)c5)c4)c3)nc2nc1Cl
Systematic name  (3):
  • 2-クロロ-7-[3,5-ビス[3,5-ビス[3,5-ビス[3,5-ジ(tert-ブチル)ベンジルオキシ]ベンジルオキシ]ベンジルオキシ]ベンジルアミノ]-1,8-ナフチリジン-3-カルボン酸エチル
  • エチル 7-({[3,5-ビス({[3,5-ビス({3,5-ビス[(3,5-ジ-tert-ブチルフェニル)メトキシ]フェニル}メトキシ)フェニル]メトキシ})フェニル]メチル}アミノ)-2-クロロ-1,8-ナフチリジン-3-カルボキシラート
  • ethyl 7-({[3,5-bis({[3,5-bis({3,5-bis[(3,5-di-tert-butylphenyl)methoxy]phenyl}methoxy)phenyl]methoxy})phenyl]methyl}amino)-2-chloro-1,8-naphthyridine-3-carboxylate
Other name (1):
  • 2-Chloro-7-[3,5-bis[3,5-bis[3,5-bis[3,5-di(tert-butyl)benzyloxy]benzyloxy]benzyloxy]benzylamino]-1,8-naphthyridine-3-carboxylic acid ethyl ester
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