3-(2-methoxy-3-methyl-phenyl)pentanedioic acid

Systemtic Name: 3-(2-methoxy-3-methyl-phenyl)pentanedioic acid Openeye Name: 3-(2-methoxy-3-methyl-phenyl)pentanedioic acid CAS Name: 3-(2-methoxy-3-methylphenyl)pentanedioic acid IUPAC Name: 3-(2-methoxy-3-methylphenyl)pentanedioic acid Traditional Name: 3-(2-methoxy-3-methyl-phenyl)glutaric acid Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(CC(=O)O)CC(=O)O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C(CC(=O)O)CC(=O)O)OC

InChI

InChI=1S/C13H16O5/c1-8-4-3-5-10(13(8)18-2)9(6-11(14)15)7-12(16)17/h3-5,9H,6-7H2,1-2H3,(H,14,15)(H,16,17)