(2-benzamido-2-oxidanylidene-ethyl) 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (2-benzamido-2-oxo-ethyl) 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-3-piperidinecarboxylic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylnipecotic acid (2-benzamido-2-keto-ethyl) ester Formula: C21H21ClN2O6S MolecularWeight: 464.91924

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Cl)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21ClN2O6S/c22-17-8-10-18(11-9-17)31(28,29)24-12-4-7-16(13-24)21(27)30-14-19(25)23-20(26)15-5-2-1-3-6-15/h1-3,5-6,8-11,16H,4,7,12-14H2,(H,23,25,26)