2-[4-(phenylmethyl)piperazin-1-yl]butanoic acid

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]butanoic acid Openeye Name: 2-(4-benzylpiperazin-1-yl)butanoic acid CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]butanoic acid IUPAC Name: 2-(4-benzylpiperazin-1-yl)butanoic acid Traditional Name: 2-(4-benzylpiperazino)butyric acid Formula: C15H22N2O2 MolecularWeight: 262.34738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)O)N1CCN(CC1)CC2=CC=CC=C2

InChI

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