2,3,4-trimethoxy-5-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxy-benzoic acid

Systemtic Name: 2,3,4-trimethoxy-5-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxy-benzoic acid Openeye Name: 5-[(E)-4-hydroxy-4-oxo-but-2-enoyl]oxy-2,3,4-trimethoxy-benzoic acid CAS Name: 5-[(E)-4-hydroxy-1,4-dioxobut-2-enoxy]-2,3,4-trimethoxybenzoic acid IUPAC Name: 5-[(E)-4-hydroxy-4-oxobut-2-enoyl]oxy-2,3,4-trimethoxybenzoic acid Traditional Name: 5-[(E)-4-hydroxy-4-keto-but-2-enoyl]oxy-2,3,4-trimethoxy-benzoic acid Formula: C14H14O9 MolecularWeight: 326.25556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1C(=O)O)OC(=O)C=CC(=O)O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1C(=O)O)OC(=O)/C=C/C(=O)O)OC)OC

InChI

InChI=1S/C14H14O9/c1-20-11-7(14(18)19)6-8(12(21-2)13(11)22-3)23-10(17)5-4-9(15)16/h4-6H,1-3H3,(H,15,16)(H,18,19)/b5-4+