methyl 4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-(trifluoromethyl)benzoate

Systemtic Name: methyl 4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-(trifluoromethyl)benzoate Openeye Name: methyl 4-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-(trifluoromethyl)benzoate CAS Name: 4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 4-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-(trifluoromethyl)benzoate Traditional Name: 4-[4-(4-fluorobenzoyl)piperazino]-3-(trifluoromethyl)benzoic acid methyl ester Formula: C20H18F4N2O3 MolecularWeight: 410.362133

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18F4N2O3/c1-29-19(28)14-4-7-17(16(12-14)20(22,23)24)25-8-10-26(11-9-25)18(27)13-2-5-15(21)6-3-13/h2-7,12H,8-11H2,1H3