N-[(2-chlorophenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-(3,4-dimethylphenyl)sulfonyl-N-methyl-isonipecotamide Formula: C22H27ClN2O3S MolecularWeight: 434.97938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=CC=C3Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=CC=C3Cl)C

InChI

InChI=1S/C22H27ClN2O3S/c1-16-8-9-20(14-17(16)2)29(27,28)25-12-10-18(11-13-25)22(26)24(3)15-19-6-4-5-7-21(19)23/h4-9,14,18H,10-13,15H2,1-3H3