2-[1-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxypropan-2-yloxycarbonyl]benzoic acid

Systemtic Name: 2-[1-[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]oxypropan-2-yloxycarbonyl]benzoic acid Openeye Name: 2-[2-[(E)-4-hydroxy-4-oxo-but-2-enoyl]oxy-1-methyl-ethoxy]carbonylbenzoic acid CAS Name: 2-[1-[(E)-4-hydroxy-1,4-dioxobut-2-enoxy]propan-2-yloxy-oxomethyl]benzoic acid IUPAC Name: 2-[1-[(E)-4-hydroxy-4-oxobut-2-enoyl]oxypropan-2-yloxycarbonyl]benzoic acid Traditional Name: 2-[2-[(E)-4-hydroxy-4-keto-but-2-enoyl]oxy-1-methyl-ethoxy]carbonylbenzoic acid Formula: C15H14O8 MolecularWeight: 322.26686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14O8/c1-9(8-22-13(18)7-6-12(16)17)23-15(21)11-5-3-2-4-10(11)14(19)20/h2-7,9H,8H2,1H3,(H,16,17)(H,19,20)/b7-6+