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

Systemtic Name: 2-[4-[2-(3-methylphenoxy)ethanoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[2-(3-methylphenoxy)-1-oxoethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-(3-methylphenoxy)acetyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-(3-methylphenoxy)acetyl]piperazino]acetic acid Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O4/c1-12-3-2-4-13(9-12)21-11-14(18)17-7-5-16(6-8-17)10-15(19)20/h2-4,9H,5-8,10-11H2,1H3,(H,19,20)