methyl 4-(4-ethanoylpiperazin-1-yl)-3-(trifluoromethyl)benzoate

Systemtic Name: methyl 4-(4-ethanoylpiperazin-1-yl)-3-(trifluoromethyl)benzoate Openeye Name: methyl 4-(4-acetylpiperazin-1-yl)-3-(trifluoromethyl)benzoate CAS Name: 4-(4-acetyl-1-piperazinyl)-3-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-acetylpiperazin-1-yl)-3-(trifluoromethyl)benzoate Traditional Name: 4-(4-acetylpiperazino)-3-(trifluoromethyl)benzoic acid methyl ester Formula: C15H17F3N2O3 MolecularWeight: 330.30229

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)C(F)(F)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C15H17F3N2O3/c1-10(21)19-5-7-20(8-6-19)13-4-3-11(14(22)23-2)9-12(13)15(16,17)18/h3-4,9H,5-8H2,1-2H3