3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzoic acid hydrochloride

Systemtic Name: 3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzoic acid hydrochloride Openeye Name: 3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzoic acid hydrochloride CAS Name: 3-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)benzoic acid hydrochloride IUPAC Name: 3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)benzoic acid hydrochloride Traditional Name: 3-(4-methylpiperazino)-5-(trifluoromethyl)benzoic acid hydrochloride Formula: C13H16ClF3N2O2 MolecularWeight: 324.72655

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=CC(=C2)C(F)(F)F)C(=O)O.Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC(=CC(=C2)C(F)(F)F)C(=O)O.Cl

InChI

InChI=1S/C13H15F3N2O2.ClH/c1-17-2-4-18(5-3-17)11-7-9(12(19)20)6-10(8-11)13(14,15)16;/h6-8H,2-5H2,1H3,(H,19,20);1H