Chem
J-GLOBAL ID：200907031241537679   Nikkaji number：J1.960.356C

5,15-Bis(3,5-di-tert-butylphenyl)-10,20-bis[3-(methoxycarbonyl)-1-azulenyl]-21H,23H-porphyrin

5,15-ビス(3,5-ジ-tert-ブチルフェニル)-10,20-ビス[3-(メトキシカルボニル)-1-アズレニル]-21H,23H-ポルフィリン
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： C72H70N4O4
Molecular formula furigana： C72-H70-N4-O4
Molecular weight： 1055.376
InChI： InChI=1S/C72H70N4O4/c1-69(2,3)43-33-41(34-44(37-43)70(4,5)6)63-55-25-29-59(73-55)65(51-39-53(67(77)79-13)49-23-19-15-17-21-47(49)51)61-31-27-57(75-61)64(42-35-45(71(7,8)9)38-46(36-42)72(10,11)12)58-28-32-62(76-58)66(60-30-26-56(63)74-60)52-40-54(68(78)80-14)50-24-20-16-18-22-48(50)52/h15-40,73,76H,1-14H3/b63-55-,63-56-,64-57-,64-58-,65-59-,65-61-,66-60-,66-62-
InChI key： AIMQMKSXZRRVNU-NOLMUMSRSA-N
SMILES： COC(=O)c1cc(/C/2=c/3\cc/c(=C(/C4=N/C(=C(\c5ccc(/C(=C\6/C=CC2=N6)/c2cc(cc(c2)C(C)(C)C)C(C)(C)C)[nH]5)/c2cc(C(=O)OC)c5cccccc25)/C=C4)\c2cc(cc(c2)C(C)(C)C)C(C)(C)C)/[nH]3)c2cccccc12
Systematic name  (3)：
  • 5,15-ビス(3,5-ジ-tert-ブチルフェニル)-10,20-ビス[3-(メトキシカルボニル)-1-アズレニル]-21H,23H-ポルフィリン
  • メチル 3-[7,17-ビス(3,5-ジ-tert-ブチルフェニル)-12-[3-(メトキシカルボニル)アズレン-1-イル]-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3(24),4,6,8,10,12,14,16(22),17,19-ウンデカエン-2-イル]アズレン-1-カルボキシラート
  • methyl 3-[7,17-bis(3,5-di-tert-butylphenyl)-12-[3-(methoxycarbonyl)azulen-1-yl]-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl]azulene-1-carboxylate
Other name (1)：
  • 5,15-Bis(3,5-di-tert-butylphenyl)-10,20-bis[3-(methoxycarbonyl)-1-azulenyl]-21H,23H-porphyrin
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM