ethyl 1-[2-[(3-chlorophenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(3-chlorophenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[N-(benzenesulfonyl)-3-chloro-anilino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[N-(benzenesulfonyl)-3-chloroanilino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[N-(benzenesulfonyl)-3-chloroanilino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-besyl-3-chloro-anilino)acetyl]isonipecotic acid ethyl ester Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H25ClN2O5S/c1-2-30-22(27)17-11-13-24(14-12-17)21(26)16-25(19-8-6-7-18(23)15-19)31(28,29)20-9-4-3-5-10-20/h3-10,15,17H,2,11-14,16H2,1H3