2-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-[2-(3-methylphenoxy)-1-oxoethyl]-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-keto-2-[4-[2-(3-methylphenoxy)acetyl]piperazino]acetic acid Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O5/c1-11-3-2-4-12(9-11)22-10-13(18)16-5-7-17(8-6-16)14(19)15(20)21/h2-4,9H,5-8,10H2,1H3,(H,20,21)