2-[4-oxidanylidene-4-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)oxy-butanoyl]oxy-3-phenyl-propanoic acid

Systemtic Name: 2-[4-oxidanylidene-4-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)oxy-butanoyl]oxy-3-phenyl-propanoic acid Openeye Name: 2-[4-(1-benzyl-2-hydroxy-2-oxo-ethoxy)-4-oxo-butanoyl]oxy-3-phenyl-propanoic acid CAS Name: 2-[4-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)oxy-1,4-dioxobutoxy]-3-phenylpropanoic acid IUPAC Name: 2-[4-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)oxy-4-oxobutanoyl]oxy-3-phenylpropanoic acid Traditional Name: 2-[4-(1-benzyl-2-hydroxy-2-keto-ethoxy)-4-keto-butanoyl]oxy-3-phenyl-propionic acid Formula: C22H22O8 MolecularWeight: 414.40528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)OC(=O)CCC(=O)OC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)OC(=O)CCC(=O)OC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H22O8/c23-19(29-17(21(25)26)13-15-7-3-1-4-8-15)11-12-20(24)30-18(22(27)28)14-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H,25,26)(H,27,28)