4-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-3-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]oxy-3-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxy-4-oxo-butanoic acid CAS Name: 4-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enoxy]-3-hydroxy-4-oxobutanoic acid IUPAC Name: 4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3-hydroxy-4-oxobutanoic acid Traditional Name: 4-[(E)-3-(3,4-dihydroxyphenyl)acryloyl]oxy-3-hydroxy-4-keto-butyric acid Formula: C13H12O8 MolecularWeight: 296.22958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)OC(=O)C(CC(=O)O)O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C13H12O8/c14-8-3-1-7(5-9(8)15)2-4-12(19)21-13(20)10(16)6-11(17)18/h1-5,10,14-16H,6H2,(H,17,18)/b4-2+