2,3-bis(2-methoxycarbonylphenyl)-6-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)benzoic acid

Systemtic Name: 2,3-bis(2-methoxycarbonylphenyl)-6-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)benzoic acid Openeye Name: 6-(2-hydroxy-1,1-dimethyl-2-oxo-ethyl)-2,3-bis(2-methoxycarbonylphenyl)benzoic acid CAS Name: 6-(1-hydroxy-2-methyl-1-oxopropan-2-yl)-2,3-bis(2-methoxycarbonylphenyl)benzoic acid IUPAC Name: 6-(1-hydroxy-2-methyl-1-oxopropan-2-yl)-2,3-bis(2-methoxycarbonylphenyl)benzoic acid Traditional Name: 2,3-bis(2-carbomethoxyphenyl)-6-(2-hydroxy-2-keto-1,1-dimethyl-ethyl)benzoic acid Formula: C27H24O8 MolecularWeight: 476.47466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(C(=C(C=C1)C2=CC=CC=C2C(=O)OC)C3=CC=CC=C3C(=O)OC)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C1=C(C(=C(C=C1)C2=CC=CC=C2C(=O)OC)C3=CC=CC=C3C(=O)OC)C(=O)O)C(=O)O

InChI

InChI=1S/C27H24O8/c1-27(2,26(32)33)20-14-13-17(15-9-5-7-11-18(15)24(30)34-3)21(22(20)23(28)29)16-10-6-8-12-19(16)25(31)35-4/h5-14H,1-4H3,(H,28,29)(H,32,33)