N-(2-ethyl-6-methyl-phenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(2-ethyl-6-methyl-phenyl)piperidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(2-ethyl-6-methylphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(2-ethyl-6-methylphenyl)piperidine-3-carboxamide Traditional Name: 1-besyl-N-(2-ethyl-6-methyl-phenyl)nipecotamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C21H26N2O3S/c1-3-17-10-7-9-16(2)20(17)22-21(24)18-11-8-14-23(15-18)27(25,26)19-12-5-4-6-13-19/h4-7,9-10,12-13,18H,3,8,11,14-15H2,1-2H3,(H,22,24)