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

Systemtic Name: 2-[(E)-3-[3,4-bis(oxidanyl)phenyl]prop-2-enoyl]-2-oxidanyl-butanedioic acid Openeye Name: 2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxy-butanedioic acid CAS Name: 2-[(E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-enyl]-2-hydroxybutanedioic acid IUPAC Name: 2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxybutanedioic acid Traditional Name: 2-[(E)-3-(3,4-dihydroxyphenyl)acryloyl]-2-hydroxy-succinic acid Formula: C13H12O8 MolecularWeight: 296.22958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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