3-(3,4-dimethoxyphenyl)pentanedioate

Systemtic Name: 3-(3,4-dimethoxyphenyl)pentanedioate Openeye Name: 3-(3,4-dimethoxyphenyl)pentanedioate CAS Name: 3-(3,4-dimethoxyphenyl)pentanedioate IUPAC Name: 3-(3,4-dimethoxyphenyl)pentanedioate Traditional Name: 3-(3,4-dimethoxyphenyl)glutarate Formula: C13H14O6-2 MolecularWeight: 266.24666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)[O-])CC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)[O-])CC(=O)[O-])OC

InChI

InChI=1S/C13H16O6/c1-18-10-4-3-8(5-11(10)19-2)9(6-12(14)15)7-13(16)17/h3-5,9H,6-7H2,1-2H3,(H,14,15)(H,16,17)/p-2