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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-28-19-8-10-20(11-9-19)29(26,27)24-14-2-3-17(15-24)21(25)23-13-12-16-4-6-18(22)7-5-16/h4-11,17H,2-3,12-15H2,1H3,(H,23,25)