3-cyano-3-(4-methoxyphenyl)pentanedioic acid

Systemtic Name: 3-cyano-3-(4-methoxyphenyl)pentanedioic acid Openeye Name: 3-cyano-3-(4-methoxyphenyl)pentanedioic acid CAS Name: 3-cyano-3-(4-methoxyphenyl)pentanedioic acid IUPAC Name: 3-cyano-3-(4-methoxyphenyl)pentanedioic acid Traditional Name: 3-cyano-3-(4-methoxyphenyl)glutaric acid Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)O)(CC(=O)O)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(CC(=O)O)(CC(=O)O)C#N

InChI

InChI=1S/C13H13NO5/c1-19-10-4-2-9(3-5-10)13(8-14,6-11(15)16)7-12(17)18/h2-5H,6-7H2,1H3,(H,15,16)(H,17,18)