Chem
J-GLOBAL ID：200907063540809188   Nikkaji number：J1.694.261H

5-(4-Acetoxyphenyl)-15-[4-(decyloxy)phenyl]-10,20-dimesityl-21H,23H-porphyrin

5-(4-アセトキシフェニル)-15-[4-(デシルオキシ)フェニル]-10,20-ジメシチル-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： C62H64N4O3
Molecular formula furigana： C62-H64-N4-O3
Molecular weight： 913.219
InChI： InChI=1S/C62H64N4O3/c1-9-10-11-12-13-14-15-16-33-68-47-21-17-45(18-22-47)59-49-25-29-53(63-49)61(57-40(4)34-38(2)35-41(57)5)55-31-27-51(65-55)60(46-19-23-48(24-20-46)69-44(8)67)52-28-32-56(66-52)62(54-30-26-50(59)64-54)58-42(6)36-39(3)37-43(58)7/h17-32,34-37,63,66H,9-16,33H2,1-8H3/b59-49-,59-50-,60-51-,60-52-,61-53+,61-55+,62-54+,62-56+
InChI key： RJHJWZFOJYOIRI-WRVJDVHLSA-N
SMILES： CCCCCCCCCCOc1ccc(cc1)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/c1c(C)cc(C)cc1C)[nH]4)/c1ccc(OC(=O)C)cc1)/C=C3)\c1c(C)cc(C)cc1C)/[nH]2
Systematic name  (3)：
  • 5-(4-アセトキシフェニル)-15-[4-(デシルオキシ)フェニル]-10,20-ジメシチル-21H,23H-ポルフィリン
  • 4-{12-[4-(デシルオキシ)フェニル]-7,17-ビス(2,4,6-トリメチルフェニル)-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 アセタート
  • 4-{12-[4-(decyloxy)phenyl]-7,17-bis(2,4,6-trimethylphenyl)-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 acetate
Other name (1)：
  • 5-(4-Acetoxyphenyl)-15-[4-(decyloxy)phenyl]-10,20-dimesityl-21H,23H-porphyrin
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