N-[2-(4-chlorophenyl)ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-tosyl-nipecotamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O3S/c1-16-4-10-20(11-5-16)28(26,27)24-14-2-3-18(15-24)21(25)23-13-12-17-6-8-19(22)9-7-17/h4-11,18H,2-3,12-15H2,1H3,(H,23,25)