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

Systemtic Name: 2-[4-[3-(3-methylphenoxy)propanoyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[3-(3-methylphenoxy)propanoyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[3-(3-methylphenoxy)-1-oxopropyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[3-(3-methylphenoxy)propanoyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[3-(3-methylphenoxy)propanoyl]piperazino]acetic acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-13-3-2-4-14(11-13)22-10-5-15(19)18-8-6-17(7-9-18)12-16(20)21/h2-4,11H,5-10,12H2,1H3,(H,20,21)