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

Systemtic Name: 3-[[4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(4-chloro-3-indolin-1-ylsulfonyl-benzoyl)amino]-4-methyl-benzoic acid CAS Name: 3-[[[4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[[4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]amino]-4-methylbenzoic acid Traditional Name: 3-[(4-chloro-3-indolin-1-ylsulfonyl-benzoyl)amino]-4-methyl-benzoic acid Formula: C23H19ClN2O5S MolecularWeight: 470.92536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19ClN2O5S/c1-14-6-7-17(23(28)29)12-19(14)25-22(27)16-8-9-18(24)21(13-16)32(30,31)26-11-10-15-4-2-3-5-20(15)26/h2-9,12-13H,10-11H2,1H3,(H,25,27)(H,28,29)