9-(3-tert-butylsulfonylphenyl)carbonyl-8-phenyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid

Systemtic Name: 9-(3-tert-butylsulfonylphenyl)carbonyl-8-phenyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Openeye Name: 9-(3-tert-butylsulfonylbenzoyl)-8-phenyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid CAS Name: 9-[(3-tert-butylsulfonylphenyl)-oxomethyl]-8-phenyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid IUPAC Name: 9-(3-tert-butylsulfonylbenzoyl)-8-phenyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Traditional Name: 9-(3-tert-butylsulfonylbenzoyl)-8-phenyl-2,4-dihydro-1H-carbazole-3,3-dicarboxylic acid Formula: C31H29NO7S MolecularWeight: 559.62946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2C3=C(CC(CC3)(C(=O)O)C(=O)O)C4=C2C(=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2C3=C(CC(CC3)(C(=O)O)C(=O)O)C4=C2C(=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H29NO7S/c1-30(2,3)40(38,39)21-12-7-11-20(17-21)27(33)32-25-15-16-31(28(34)35,29(36)37)18-24(25)23-14-8-13-22(26(23)32)19-9-5-4-6-10-19/h4-14,17H,15-16,18H2,1-3H3,(H,34,35)(H,36,37)