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

Systemtic Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanoic acid Openeye Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-2-yl]acetic acid CAS Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazinyl]acetic acid IUPAC Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetic acid Traditional Name: 2-(3-keto-1-veratryl-piperazin-2-yl)acetic acid Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCNC(=O)C2CC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCNC(=O)C2CC(=O)O)OC

InChI

InChI=1S/C15H20N2O5/c1-21-12-4-3-10(7-13(12)22-2)9-17-6-5-16-15(20)11(17)8-14(18)19/h3-4,7,11H,5-6,8-9H2,1-2H3,(H,16,20)(H,18,19)