2-[chloranyl-[2-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]methyl]-3-oxidanylidene-butanoic acid

Systemtic Name: 2-[chloranyl-[2-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]methyl]-3-oxidanylidene-butanoic acid Openeye Name: 2-[chloro-[2-[(E)-3-hydroxy-3-oxo-prop-1-enyl]phenyl]methyl]-3-oxo-butanoic acid CAS Name: 2-[chloro-[2-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]methyl]-3-oxobutanoic acid IUPAC Name: 2-[chloro-[2-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]methyl]-3-oxobutanoic acid Traditional Name: 2-[chloro-[2-[(E)-3-hydroxy-3-keto-prop-1-enyl]phenyl]methyl]-3-keto-butyric acid Formula: C14H13ClO5 MolecularWeight: 296.70302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClO5/c1-8(16)12(14(19)20)13(15)10-5-3-2-4-9(10)6-7-11(17)18/h2-7,12-13H,1H3,(H,17,18)(H,19,20)/b7-6+