3-(2,5-dimethoxyphenyl)carbonyl-1-(phenylsulfonyl)indole-2-carboxylic acid

Systemtic Name: 3-(2,5-dimethoxyphenyl)carbonyl-1-(phenylsulfonyl)indole-2-carboxylic acid Openeye Name: 1-(benzenesulfonyl)-3-(2,5-dimethoxybenzoyl)indole-2-carboxylic acid CAS Name: 1-(benzenesulfonyl)-3-[(2,5-dimethoxyphenyl)-oxomethyl]-2-indolecarboxylic acid IUPAC Name: 1-(benzenesulfonyl)-3-(2,5-dimethoxybenzoyl)indole-2-carboxylic acid Traditional Name: 1-besyl-3-(2,5-dimethoxybenzoyl)indole-2-carboxylic acid Formula: C24H19NO7S MolecularWeight: 465.47516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C2=C(N(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)C2=C(N(C3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H19NO7S/c1-31-15-12-13-20(32-2)18(14-15)23(26)21-17-10-6-7-11-19(17)25(22(21)24(27)28)33(29,30)16-8-4-3-5-9-16/h3-14H,1-2H3,(H,27,28)