[(E)-2-methyl-4-[oxidanyl(phosphonooxy)phosphoryl]oxy-but-2-enyl] 3-(phenylcarbonyl)benzoate

Systemtic Name: [(E)-2-methyl-4-[oxidanyl(phosphonooxy)phosphoryl]oxy-but-2-enyl] 3-(phenylcarbonyl)benzoate Openeye Name: [(E)-4-[hydroxy(phosphonooxy)phosphoryl]oxy-2-methyl-but-2-enyl] 3-benzoylbenzoate CAS Name: 3-benzoylbenzoic acid [(E)-4-[hydroxy(phosphonooxy)phosphoryl]oxy-2-methylbut-2-enyl] ester IUPAC Name: [(E)-4-[hydroxy(phosphonooxy)phosphoryl]oxy-2-methylbut-2-enyl] 3-benzoylbenzoate Traditional Name: 3-benzoylbenzoic acid [(E)-4-[hydroxy(phosphonooxy)phosphoryl]oxy-2-methyl-but-2-enyl] ester Formula: C19H20O10P2 MolecularWeight: 470.303622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOP(=O)(O)OP(=O)(O)O)COC(=O)C1=CC=CC(=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

C/C(=C\COP(=O)(O)OP(=O)(O)O)/COC(=O)C1=CC=CC(=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H20O10P2/c1-14(10-11-28-31(25,26)29-30(22,23)24)13-27-19(21)17-9-5-8-16(12-17)18(20)15-6-3-2-4-7-15/h2-10,12H,11,13H2,1H3,(H,25,26)(H2,22,23,24)/b14-10+