(E)-2-(4-acetyloxyphenyl)-3-methyl-but-2-enedioic acid

Systemtic Name: (E)-2-(4-acetyloxyphenyl)-3-methyl-but-2-enedioic acid Openeye Name: (E)-2-(4-acetoxyphenyl)-3-methyl-but-2-enedioic acid CAS Name: (E)-2-(4-acetyloxyphenyl)-3-methyl-2-butenedioic acid IUPAC Name: (E)-2-(4-acetyloxyphenyl)-3-methylbut-2-enedioic acid Traditional Name: (E)-2-(4-acetoxyphenyl)-3-methyl-but-2-enedioic acid Formula: C13H12O6 MolecularWeight: 264.23078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(/C1=CC=C(C=C1)OC(=O)C)\C(=O)O)/C(=O)O

InChI

InChI=1S/C13H12O6/c1-7(12(15)16)11(13(17)18)9-3-5-10(6-4-9)19-8(2)14/h3-6H,1-2H3,(H,15,16)(H,17,18)/b11-7+