[1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 4-methyl-3-sulfamoyl-benzoate

Systemtic Name: [1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-propan-2-yl] 4-methyl-3-sulfamoyl-benzoate Openeye Name: [2-[benzyl(methyl)amino]-1-methyl-2-oxo-ethyl] 4-methyl-3-sulfamoyl-benzoate CAS Name: 4-methyl-3-sulfamoylbenzoic acid [1-[methyl-(phenylmethyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[benzyl(methyl)amino]-1-oxopropan-2-yl] 4-methyl-3-sulfamoylbenzoate Traditional Name: 4-methyl-3-sulfamoyl-benzoic acid [2-[benzyl(methyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C19H22N2O5S MolecularWeight: 390.45338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)N(C)CC2=CC=CC=C2)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)N(C)CC2=CC=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C19H22N2O5S/c1-13-9-10-16(11-17(13)27(20,24)25)19(23)26-14(2)18(22)21(3)12-15-7-5-4-6-8-15/h4-11,14H,12H2,1-3H3,(H2,20,24,25)