[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate

Systemtic Name: [2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Openeye Name: [2-(3-methyl-1-piperidyl)-2-oxo-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-(3-methyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methylpiperidin-1-yl)-2-oxoethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-keto-2-(3-methylpiperidino)ethyl] ester Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CCCN(C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O5S/c1-15-5-4-12-24(13-15)20(25)14-29-21(26)18-6-2-3-7-19(18)23-30(27,28)17-10-8-16(22)9-11-17/h2-3,6-11,15,23H,4-5,12-14H2,1H3