ethyl 1-[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(3-chlorophenyl)methyl-(p-tolylsulfonyl)amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(3-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(3-chlorobenzyl)-tosyl-amino]acetyl]isonipecotic acid ethyl ester Formula: C24H29ClN2O5S MolecularWeight: 493.01546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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