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

Systemtic Name: N-(4-butyl-2-methyl-phenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: N-(4-butyl-2-methyl-phenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: N-(4-butyl-2-methylphenyl)-4-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: N-(4-butyl-2-methylphenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: N-(4-butyl-2-methyl-phenyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C23H28F3N3O MolecularWeight: 419.48313

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C23H28F3N3O/c1-3-4-6-18-9-10-21(17(2)15-18)27-22(30)29-13-11-28(12-14-29)20-8-5-7-19(16-20)23(24,25)26/h5,7-10,15-16H,3-4,6,11-14H2,1-2H3,(H,27,30)