Chem
J-GLOBAL ID：200907020417431978   Nikkaji number：J1.068.129D

3,7,13,17-Tetramethyl-2,8,12,18-tetraethyl-5,15-bis[2-(acetylamino)phenyl]-21H,23H-porphyrin

3,7,13,17-テトラメチル-2,8,12,18-テトラエチル-5,15-ビス[2-(アセチルアミノ)フェニル]-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： C48H52N6O2
Molecular formula furigana： C48-H52-N6-O2
Molecular weight： 744.984
InChI： InChI=1S/C48H52N6O2/c1-11-31-25(5)45-43(35-19-15-17-21-37(35)49-29(9)55)46-27(7)33(13-3)41(53-46)24-42-34(14-4)28(8)48(54-42)44(36-20-16-18-22-38(36)50-30(10)56)47-26(6)32(12-2)40(52-47)23-39(31)51-45/h15-24,51,54H,11-14H2,1-10H3,(H,49,55)(H,50,56)/b39-23-,40-23-,41-24-,42-24-,45-43-,46-43-,47-44-,48-44-
InChI key： NCZCSKHBUQESRE-USNRUAOBSA-N
SMILES： CCC1=C(C)C2=N/C/1=C\c1[nH]c(c(C)c1CC)/C(=C/1\N=C(/C=c/3\[nH]/c(=C\2/c2ccccc2NC(=O)C)/c(C)c3CC)C(=C1C)CC)/c1ccccc1NC(=O)C
Systematic name  (3)：
  • 3,7,13,17-テトラメチル-2,8,12,18-テトラエチル-5,15-ビス[2-(アセチルアミノ)フェニル]-21H,23H-ポルフィリン
  • N-{2-[12-(2-アセトアミドフェニル)-5,9,15,19-テトラエチル-4,10,14,20-テトラメチル-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-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン-2-イル]フェニル}アセトアミド
  • N-{2-[12-(2-acetamidophenyl)-5,9,15,19-tetraethyl-4,10,14,20-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-2-yl]phenyl}acetamide
Other name (1)：
  • 3,7,13,17-Tetramethyl-2,8,12,18-tetraethyl-5,15-bis[2-(acetylamino)phenyl]-21H,23H-porphyrin
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