(2E,4E)-5-(1,3-benzodioxol-5-yl)-4-methyl-penta-2,4-dienoic acid

Systemtic Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-4-methyl-penta-2,4-dienoic acid Openeye Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-4-methyl-penta-2,4-dienoic acid CAS Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-4-methylpenta-2,4-dienoic acid IUPAC Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-4-methylpenta-2,4-dienoic acid Traditional Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-4-methyl-penta-2,4-dienoic acid Formula: C13H12O4 MolecularWeight: 232.23198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC2=C(C=C1)OCO2)C=CC(=O)O

Isomeric SMILES

C/C(=C\C1=CC2=C(C=C1)OCO2)/C=C/C(=O)O

InChI

InChI=1S/C13H12O4/c1-9(2-5-13(14)15)6-10-3-4-11-12(7-10)17-8-16-11/h2-7H,8H2,1H3,(H,14,15)/b5-2+,9-6+