6-cyclohexa-2,5-dien-1-yl-4-oxidanyl-1,3-benzodioxole-5-carboxylic acid

Systemtic Name: 6-cyclohexa-2,5-dien-1-yl-4-oxidanyl-1,3-benzodioxole-5-carboxylic acid Openeye Name: 6-cyclohexa-2,5-dien-1-yl-4-hydroxy-1,3-benzodioxole-5-carboxylic acid CAS Name: 6-(1-cyclohexa-2,5-dienyl)-4-hydroxy-1,3-benzodioxole-5-carboxylic acid IUPAC Name: 6-cyclohexa-2,5-dien-1-yl-4-hydroxy-1,3-benzodioxole-5-carboxylic acid Traditional Name: 6-cyclohexa-2,5-dien-1-yl-4-hydroxy-piperonylic acid Formula: C14H12O5 MolecularWeight: 260.24208

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C=C1)C2=CC3=C(C(=C2C(=O)O)O)OCO3

Isomeric SMILES

C1C=CC(C=C1)C2=CC3=C(C(=C2C(=O)O)O)OCO3

InChI

InChI=1S/C14H12O5/c15-12-11(14(16)17)9(8-4-2-1-3-5-8)6-10-13(12)19-7-18-10/h2-6,8,15H,1,7H2,(H,16,17)