N-(3-ethanoylphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(3-acetylphenyl)-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: N-(3-acetylphenyl)-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(3-acetylphenyl)-1-tosyl-nipecotamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H24N2O4S/c1-15-8-10-20(11-9-15)28(26,27)23-12-4-6-18(14-23)21(25)22-19-7-3-5-17(13-19)16(2)24/h3,5,7-11,13,18H,4,6,12,14H2,1-2H3,(H,22,25)