[2-[4-(methylsulfonylamino)phenyl]-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate

Systemtic Name: [2-[4-(methylsulfonylamino)phenyl]-2-oxidanylidene-ethyl] 4-(1H-indol-3-yl)butanoate Openeye Name: [2-[4-(methanesulfonamido)phenyl]-2-oxo-ethyl] 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [2-[4-(methanesulfonamido)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(methanesulfonamido)phenyl]-2-oxoethyl] 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [2-keto-2-[4-(methanesulfonamido)phenyl]ethyl] ester Formula: C21H22N2O5S MolecularWeight: 414.47478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)C(=O)COC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O5S/c1-29(26,27)23-17-11-9-15(10-12-17)20(24)14-28-21(25)8-4-5-16-13-22-19-7-3-2-6-18(16)19/h2-3,6-7,9-13,22-23H,4-5,8,14H2,1H3