4-[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[(3-indolin-1-ylsulfonylbenzoyl)amino]-3-methyl-benzoic acid CAS Name: 4-[[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[[3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]amino]-3-methylbenzoic acid Traditional Name: 4-[(3-indolin-1-ylsulfonylbenzoyl)amino]-3-methyl-benzoic acid Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C23H20N2O5S/c1-15-13-18(23(27)28)9-10-20(15)24-22(26)17-6-4-7-19(14-17)31(29,30)25-12-11-16-5-2-3-8-21(16)25/h2-10,13-14H,11-12H2,1H3,(H,24,26)(H,27,28)