2-[4-(2,5-dimethylphenyl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(2,5-dimethylphenyl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(2,5-dimethylbenzoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(2,5-dimethylphenyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(2,5-dimethylbenzoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(2,5-dimethylbenzoyl)piperazino]acetic acid Formula: C15H20N2O3 MolecularWeight: 276.3309

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)N2CCN(CC2)CC(=O)O

InChI

InChI=1S/C15H20N2O3/c1-11-3-4-12(2)13(9-11)15(20)17-7-5-16(6-8-17)10-14(18)19/h3-4,9H,5-8,10H2,1-2H3,(H,18,19)