ethyl 1-[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(4-chlorophenyl)methyl-(p-tolylsulfonyl)amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(4-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(4-chlorobenzyl)-tosyl-amino]acetyl]isonipecotic acid ethyl ester Formula: C24H29ClN2O5S MolecularWeight: 493.01546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H29ClN2O5S/c1-3-32-24(29)20-12-14-26(15-13-20)23(28)17-27(16-19-6-8-21(25)9-7-19)33(30,31)22-10-4-18(2)5-11-22/h4-11,20H,3,12-17H2,1-2H3