1-[(3-chlorophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)-3-methyl-butyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)-3-methyl-butyl]piperidine-4-carboxamide Openeye Name: 1-[(3-chlorophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)-3-methyl-butyl]piperidine-4-carboxamide CAS Name: 1-[(3-chlorophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)-3-methylbutyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-chlorophenyl)methylsulfonyl]-N-[1-(4-methoxyphenyl)-3-methylbutyl]piperidine-4-carboxamide Traditional Name: 1-(3-chlorobenzyl)sulfonyl-N-[1-(4-methoxyphenyl)-3-methyl-butyl]isonipecotamide Formula: C25H33ClN2O4S MolecularWeight: 493.05852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)CC(C1=CC=C(C=C1)OC)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C25H33ClN2O4S/c1-18(2)15-24(20-7-9-23(32-3)10-8-20)27-25(29)21-11-13-28(14-12-21)33(30,31)17-19-5-4-6-22(26)16-19/h4-10,16,18,21,24H,11-15,17H2,1-3H3,(H,27,29)