N-[1-(3-acetamidophenyl)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-1-(benzenesulfonyl)piperidine-3-carboxamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-1-(benzenesulfonyl)-3-piperidinecarboxamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-1-(benzenesulfonyl)piperidine-3-carboxamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-1-besyl-nipecotamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC(=CC=C1)NC(=O)C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O4S/c1-16(18-8-6-10-20(14-18)24-17(2)26)23-22(27)19-9-7-13-25(15-19)30(28,29)21-11-4-3-5-12-21/h3-6,8,10-12,14,16,19H,7,9,13,15H2,1-2H3,(H,23,27)(H,24,26)