4-[4-(2-methylpropyl)piperazin-1-yl]benzoic acid

Systemtic Name: 4-[4-(2-methylpropyl)piperazin-1-yl]benzoic acid Openeye Name: 4-(4-isobutylpiperazin-1-yl)benzoic acid CAS Name: 4-[4-(2-methylpropyl)-1-piperazinyl]benzoic acid IUPAC Name: 4-[4-(2-methylpropyl)piperazin-1-yl]benzoic acid Traditional Name: 4-(4-isobutylpiperazino)benzoic acid Formula: C15H22N2O2 MolecularWeight: 262.34738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H22N2O2/c1-12(2)11-16-7-9-17(10-8-16)14-5-3-13(4-6-14)15(18)19/h3-6,12H,7-11H2,1-2H3,(H,18,19)