ethyl 1-[2-[(3-chloranyl-4-methoxy-phenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(3-chloranyl-4-methoxy-phenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[N-(benzenesulfonyl)-3-chloro-4-methoxy-anilino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[N-(benzenesulfonyl)-3-chloro-4-methoxyanilino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[N-(benzenesulfonyl)-3-chloro-4-methoxyanilino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-besyl-3-chloro-4-methoxy-anilino)acetyl]isonipecotic acid ethyl ester Formula: C23H27ClN2O6S MolecularWeight: 494.98828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClN2O6S/c1-3-32-23(28)17-11-13-25(14-12-17)22(27)16-26(18-9-10-21(31-2)20(24)15-18)33(29,30)19-7-5-4-6-8-19/h4-10,15,17H,3,11-14,16H2,1-2H3