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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(=O)O

InChI

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