3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methyl-indole-5-carboxylic acid

Systemtic Name: 3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methyl-indole-5-carboxylic acid Openeye Name: 3-[[2-methoxy-4-(o-tolylsulfonylcarbamoyl)phenyl]methyl]-1-methyl-indole-5-carboxylic acid CAS Name: 3-[[2-methoxy-4-[[(2-methylphenyl)sulfonylamino]-oxomethyl]phenyl]methyl]-1-methyl-5-indolecarboxylic acid IUPAC Name: 3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methylindole-5-carboxylic acid Traditional Name: 3-[2-methoxy-4-(o-tolylsulfonylcarbamoyl)benzyl]-1-methyl-indole-5-carboxylic acid Formula: C26H24N2O6S MolecularWeight: 492.54356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CC3=CN(C4=C3C=C(C=C4)C(=O)O)C)OC

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC(=O)C2=CC(=C(C=C2)CC3=CN(C4=C3C=C(C=C4)C(=O)O)C)OC

InChI

InChI=1S/C26H24N2O6S/c1-16-6-4-5-7-24(16)35(32,33)27-25(29)18-9-8-17(23(14-18)34-3)12-20-15-28(2)22-11-10-19(26(30)31)13-21(20)22/h4-11,13-15H,12H2,1-3H3,(H,27,29)(H,30,31)