4-(2,3-dimethylphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxamide

Systemtic Name: 4-(2,3-dimethylphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxamide Openeye Name: 4-(2,3-dimethylphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxamide CAS Name: 4-(2,3-dimethylphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazinecarboxamide IUPAC Name: 4-(2,3-dimethylphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxamide Traditional Name: 4-(2,3-dimethylphenyl)-N-[3-(trifluoromethyl)benzyl]piperazine-1-carboxamide Formula: C21H24F3N3O MolecularWeight: 391.42997

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)NCC3=CC(=CC=C3)C(F)(F)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)NCC3=CC(=CC=C3)C(F)(F)F)C

InChI

InChI=1S/C21H24F3N3O/c1-15-5-3-8-19(16(15)2)26-9-11-27(12-10-26)20(28)25-14-17-6-4-7-18(13-17)21(22,23)24/h3-8,13H,9-12,14H2,1-2H3,(H,25,28)