[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 4-chloro-3-indolin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Traditional Name: 4-chloro-3-indolin-1-ylsulfonyl-benzoic acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C23H18ClN3O7S MolecularWeight: 515.92292

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H18ClN3O7S/c24-19-9-8-16(12-21(19)35(32,33)26-11-10-15-4-1-2-7-20(15)26)23(29)34-14-22(28)25-17-5-3-6-18(13-17)27(30)31/h1-9,12-13H,10-11,14H2,(H,25,28)