(2S)-2-(3,4-dimethoxyphenyl)butanedioic acid

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)butanedioic acid Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)butanedioic acid CAS Name: (2S)-2-(3,4-dimethoxyphenyl)butanedioic acid IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)butanedioic acid Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)succinic acid Formula: C12H14O6 MolecularWeight: 254.23596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)O)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](CC(=O)O)C(=O)O)OC

InChI

InChI=1S/C12H14O6/c1-17-9-4-3-7(5-10(9)18-2)8(12(15)16)6-11(13)14/h3-5,8H,6H2,1-2H3,(H,13,14)(H,15,16)/t8-/m0/s1