N-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-(4-methylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-(4-methylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-methylbenzoyl)piperidine-4-carboxamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-[(4-methylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-methylbenzoyl)piperidine-4-carboxamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-p-toluoyl-isonipecotamide Formula: C21H20ClF3N2O2 MolecularWeight: 424.84391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C21H20ClF3N2O2/c1-13-2-4-15(5-3-13)20(29)27-10-8-14(9-11-27)19(28)26-16-6-7-18(22)17(12-16)21(23,24)25/h2-7,12,14H,8-11H2,1H3,(H,26,28)