[1-oxidanylidene-1-(propylamino)propan-2-yl] 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 3,4-dimethyl-5-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3,4-dimethyl-5-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 3,4-dimethyl-5-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3,4-dimethyl-5-(4-methylpiperidino)sulfonyl-benzoic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C21H32N2O5S MolecularWeight: 424.55418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N2CCC(CC2)C)C)C

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N2CCC(CC2)C)C)C

InChI

InChI=1S/C21H32N2O5S/c1-6-9-22-20(24)17(5)28-21(25)18-12-15(3)16(4)19(13-18)29(26,27)23-10-7-14(2)8-11-23/h12-14,17H,6-11H2,1-5H3,(H,22,24)