2-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-[1-(3,4-dimethoxyphenyl)ethyl]-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazino]-2-keto-acetic acid Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5/c1-11(12-4-5-13(22-2)14(10-12)23-3)17-6-8-18(9-7-17)15(19)16(20)21/h4-5,10-11H,6-9H2,1-3H3,(H,20,21)