N-(5-chloranyl-2-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: N-(5-chloro-2-methylphenyl)-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-methylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-1-tosyl-nipecotamide Formula: C20H23ClN2O3S MolecularWeight: 406.92622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClN2O3S/c1-14-5-9-18(10-6-14)27(25,26)23-11-3-4-16(13-23)20(24)22-19-12-17(21)8-7-15(19)2/h5-10,12,16H,3-4,11,13H2,1-2H3,(H,22,24)