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

Systemtic Name: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Openeye Name: [2-(4-cyanoanilino)-2-oxo-ethyl] 4-chloro-3-indolin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoic acid [2-(4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-cyanoanilino)-2-oxoethyl] 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Traditional Name: 4-chloro-3-indolin-1-ylsulfonyl-benzoic acid [2-(4-cyanoanilino)-2-keto-ethyl] ester Formula: C24H18ClN3O5S MolecularWeight: 495.93482

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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=C(C=C4)C#N)Cl

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC(=O)NC4=CC=C(C=C4)C#N)Cl

InChI

InChI=1S/C24H18ClN3O5S/c25-20-10-7-18(24(30)33-15-23(29)27-19-8-5-16(14-26)6-9-19)13-22(20)34(31,32)28-12-11-17-3-1-2-4-21(17)28/h1-10,13H,11-12,15H2,(H,27,29)