N-(3-chloranyl-4-cyano-phenyl)-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-1-(2-methylbenzoyl)piperidine-4-carboxamide CAS Name: N-(3-chloro-4-cyanophenyl)-1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-1-(2-methylbenzoyl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-1-o-toluoyl-isonipecotamide Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C21H20ClN3O2/c1-14-4-2-3-5-18(14)21(27)25-10-8-15(9-11-25)20(26)24-17-7-6-16(13-23)19(22)12-17/h2-7,12,15H,8-11H2,1H3,(H,24,26)