Chem
J-GLOBAL ID:200907036121148107
Nikkaji number:J2.332.840B
1-(Phenylsulfonyl)-3′-(2-oxo-2-methoxyethyl)[2,2′-carbonylbis(1H-indole)]-3-carboxylic acid
1-(フェニルスルホニル)-3′-(2-オキソ-2-メトキシエチル)[2,2′-カルボニルビス(1H-インドール)]-3-カルボン酸
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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:
C27 H20 N2 O7 S
Molecular formula furigana:
C27-H20-N2-O7-S
Molecular weight:
516.520
InChI:
InChI=1S/C27H20N2O7S/c1-36-22(30)15-19-17-11-5-7-13-20(17)28-24(19)26(31)25-23(27(32)33)18-12-6-8-14-21(18)29(25)37(34,35)16-9-3-2-4-10-16/h2-14,28H,15H2,1H3,(H,32,33)
InChI key:
UNSODUUQXSMWRW-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1c([nH]c2ccccc12)C(=O)c1c(C(=O)O)c2ccccc2n1S(=O)(=O)c1ccccc1
Systematic name (3):
1-(フェニルスルホニル)-3′-(2-オキソ-2-メトキシエチル)[2,2′-カルボニルビス(1H-インドール)]-3-カルボン酸
1-(ベンゼンスルホニル)-2-[3-(2-メトキシ-2-オキソエチル)-1H-インドール-2-カルボニル]-1H-インドール-3-カルボン酸
1-(benzenesulfonyl)-2-[3-(2-methoxy-2-oxoethyl)-1H-indole-2-carbonyl]-1H-indole-3-carboxylic acid
Other name (1):
1-(Phenylsulfonyl)-3′-(2-oxo-2-methoxyethyl)[2,2′-carbonylbis(1H-indole)]-3-carboxylic acid
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