2-methylpropyl N-(3-fluorophenyl)carbonyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate

Systemtic Name: 2-methylpropyl N-(3-fluorophenyl)carbonyl-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate Openeye Name: isobutyl N-(3-fluorobenzoyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate CAS Name: N-[(3-fluorophenyl)-oxomethyl]-4-[3-(trifluoromethyl)phenyl]-1-piperazinecarboximidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-(3-fluorobenzoyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidate Traditional Name: N-(3-fluorobenzoyl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboximidic acid isobutyl ester Formula: C23H25F4N3O2 MolecularWeight: 451.457113

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25F4N3O2/c1-16(2)15-32-22(28-21(31)17-5-3-7-19(24)13-17)30-11-9-29(10-12-30)20-8-4-6-18(14-20)23(25,26)27/h3-8,13-14,16H,9-12,15H2,1-2H3