2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[(4-ethylphenyl)methyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-(4-ethylbenzyl)piperazino]acetic acid Formula: C15H22N2O2 MolecularWeight: 262.34738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)CC(=O)O

InChI

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