N-[1-(2,5-dimethylphenyl)ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[1-(2,5-dimethylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[1-(2,5-dimethylphenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[1-(2,5-dimethylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[1-(2,5-dimethylphenyl)ethyl]isonipecotamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S/c1-16-9-10-17(2)21(15-16)18(3)23-22(25)19-11-13-24(14-12-19)28(26,27)20-7-5-4-6-8-20/h4-10,15,18-19H,11-14H2,1-3H3,(H,23,25)