[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-[4-(methylsulfamoyl)phenyl]propanoate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-[4-(methylsulfamoyl)phenyl]propanoate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] 3-[4-(methylsulfamoyl)phenyl]propanoate CAS Name: 3-[4-(methylsulfamoyl)phenyl]propanoic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 3-[4-(methylsulfamoyl)phenyl]propanoate Traditional Name: 3-[4-(methylsulfamoyl)phenyl]propionic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCC3=CC=C(C=C3)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCC3=CC=C(C=C3)S(=O)(=O)NC

InChI

InChI=1S/C21H22N2O5S/c1-14-21(17-5-3-4-6-18(17)23-14)19(24)13-28-20(25)12-9-15-7-10-16(11-8-15)29(26,27)22-2/h3-8,10-11,22-23H,9,12-13H2,1-2H3