(3-benzamidophenyl) 1-ethylsulfonylpiperidine-4-carboxylate

Systemtic Name: (3-benzamidophenyl) 1-ethylsulfonylpiperidine-4-carboxylate Openeye Name: (3-benzamidophenyl) 1-ethylsulfonylpiperidine-4-carboxylate CAS Name: 1-ethylsulfonyl-4-piperidinecarboxylic acid (3-benzamidophenyl) ester IUPAC Name: (3-benzamidophenyl) 1-ethylsulfonylpiperidine-4-carboxylate Traditional Name: 1-esylisonipecotic acid (3-benzamidophenyl) ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)OC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)OC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O5S/c1-2-29(26,27)23-13-11-17(12-14-23)21(25)28-19-10-6-9-18(15-19)22-20(24)16-7-4-3-5-8-16/h3-10,15,17H,2,11-14H2,1H3,(H,22,24)