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

Systemtic Name: 2-[4-(2-phenylbutanoyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(2-phenylbutanoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(1-oxo-2-phenylbutyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(2-phenylbutanoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(2-phenylbutanoyl)piperazino]acetic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C16H22N2O3/c1-2-14(13-6-4-3-5-7-13)16(21)18-10-8-17(9-11-18)12-15(19)20/h3-7,14H,2,8-12H2,1H3,(H,19,20)