[1-oxidanylidene-1-(propylamino)propan-2-yl] 2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 2-methyl-5-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 2-methyl-5-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 2-methyl-5-(2-methylpiperidino)sulfonyl-benzoic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2C)C

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2C)C

InChI

InChI=1S/C20H30N2O5S/c1-5-11-21-19(23)16(4)27-20(24)18-13-17(10-9-14(18)2)28(25,26)22-12-7-6-8-15(22)3/h9-10,13,15-16H,5-8,11-12H2,1-4H3,(H,21,23)