2-[4-[2-[4-(4-oxidanyl-4-oxidanylidene-butanoyl)oxyphenyl]propan-2-yl]phenoxy]carbonylcyclohexane-1-carboxylic acid

Systemtic Name: 2-[4-[2-[4-(4-oxidanyl-4-oxidanylidene-butanoyl)oxyphenyl]propan-2-yl]phenoxy]carbonylcyclohexane-1-carboxylic acid Openeye Name: 2-[4-[1-[4-(4-hydroxy-4-oxo-butanoyl)oxyphenyl]-1-methyl-ethyl]phenoxy]carbonylcyclohexanecarboxylic acid CAS Name: 2-[[4-[2-[4-(4-hydroxy-1,4-dioxobutoxy)phenyl]propan-2-yl]phenoxy]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[4-[2-[4-(4-hydroxy-4-oxobutanoyl)oxyphenyl]propan-2-yl]phenoxy]carbonylcyclohexane-1-carboxylic acid Traditional Name: 2-[4-[1-[4-(4-hydroxy-4-keto-butanoyl)oxyphenyl]-1-methyl-ethyl]phenoxy]carbonylcyclohexanecarboxylic acid Formula: C27H30O8 MolecularWeight: 482.5223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)OC(=O)CCC(=O)O)C2=CC=C(C=C2)OC(=O)C3CCCCC3C(=O)O

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)OC(=O)CCC(=O)O)C2=CC=C(C=C2)OC(=O)C3CCCCC3C(=O)O

InChI

InChI=1S/C27H30O8/c1-27(2,17-7-11-19(12-8-17)34-24(30)16-15-23(28)29)18-9-13-20(14-10-18)35-26(33)22-6-4-3-5-21(22)25(31)32/h7-14,21-22H,3-6,15-16H2,1-2H3,(H,28,29)(H,31,32)