Chem
J-GLOBAL ID:201607005360820090   Nikkaji number:J3.533.965E

5,10-Bis(methoxycarbonyl)-2,3,7,8,12,13,17,18-octamethyl-21H,23H-porphyrin

5,10-ビス(メトキシカルボニル)-2,3,7,8,12,13,17,18-オクタメチル-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: C32H34N4O4
Molecular formula furigana: C32-H34-N4-O4
Molecular weight: 538.648
InChI: InChI=1S/C32H34N4O4/c1-13-14(2)22-12-24-16(4)18(6)28(35-24)26(32(38)40-10)30-20(8)19(7)29(36-30)25(31(37)39-9)27-17(5)15(3)23(34-27)11-21(13)33-22/h11-12,34-35H,1-10H3/b21-11-,22-12-,23-11-,24-12-,27-25+,28-26+,29-25+,30-26+
InChI key: WYLUIZRFUMSKGE-SMVCZJPFSA-N
SMILES: COC(=O)/C/1=C\2/N=C(C(=C2C)C)/C(=c/2\[nH]/c(=C\C3=N/C(=C\c4[nH]c1c(C)c4C)/C(=C3C)C)/c(C)c2C)/C(=O)OC
Systematic name  (3):
  • 5,10-ビス(メトキシカルボニル)-2,3,7,8,12,13,17,18-オクタメチル-21H,23H-ポルフィリン
  • 2,7-ジメチル 4,5,9,10,14,15,19,20-オクタメチル-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(24),4,6,8,10,12,14,16(22),17,19-ウンデカエン-2,7-ジカルボキシラート
  • 2,7-dimethyl 4,5,9,10,14,15,19,20-octamethyl-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-undecaene-2,7-dicarboxylate
Other name (1):
  • 5,10-Bis(methoxycarbonyl)-2,3,7,8,12,13,17,18-octamethyl-21H,23H-porphyrin
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