[2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxidanylidene-ethyl] 3-acetamido-3-(4-chlorophenyl)propanoate

Systemtic Name: [2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxidanylidene-ethyl] 3-acetamido-3-(4-chlorophenyl)propanoate Openeye Name: [2-(1-ethylsulfonylindolin-5-yl)-2-oxo-ethyl] 3-acetamido-3-(4-chlorophenyl)propanoate CAS Name: 3-acetamido-3-(4-chlorophenyl)propanoic acid [2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1-ethylsulfonyl-2,3-dihydroindol-5-yl)-2-oxoethyl] 3-acetamido-3-(4-chlorophenyl)propanoate Traditional Name: 3-acetamido-3-(4-chlorophenyl)propionic acid [2-(1-esylindolin-5-yl)-2-keto-ethyl] ester Formula: C23H25ClN2O6S MolecularWeight: 492.9724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)COC(=O)CC(C3=CC=C(C=C3)Cl)NC(=O)C

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)COC(=O)CC(C3=CC=C(C=C3)Cl)NC(=O)C

InChI

InChI=1S/C23H25ClN2O6S/c1-3-33(30,31)26-11-10-17-12-18(6-9-21(17)26)22(28)14-32-23(29)13-20(25-15(2)27)16-4-7-19(24)8-5-16/h4-9,12,20H,3,10-11,13-14H2,1-2H3,(H,25,27)