4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzoic acid

Systemtic Name: 4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzoic acid Openeye Name: 4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzoic acid CAS Name: 4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)benzoic acid IUPAC Name: 4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)benzoic acid Traditional Name: 4-[(4-methylpiperazino)methyl]-3-(trifluoromethyl)benzoic acid Formula: C14H17F3N2O2 MolecularWeight: 302.29219

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=C(C=C2)C(=O)O)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=C(C=C2)C(=O)O)C(F)(F)F

InChI

InChI=1S/C14H17F3N2O2/c1-18-4-6-19(7-5-18)9-11-3-2-10(13(20)21)8-12(11)14(15,16)17/h2-3,8H,4-7,9H2,1H3,(H,20,21)