2-(2,2-dimethylbutanoyl)-3,5-bis(oxidanyl)-2-(2-oxidanylidene-1H-naphthalen-1-yl)heptanoic acid

Systemtic Name: 2-(2,2-dimethylbutanoyl)-3,5-bis(oxidanyl)-2-(2-oxidanylidene-1H-naphthalen-1-yl)heptanoic acid Openeye Name: 2-(2,2-dimethylbutanoyl)-3,5-dihydroxy-2-(2-oxo-1H-naphthalen-1-yl)heptanoic acid CAS Name: 2-(2,2-dimethyl-1-oxobutyl)-3,5-dihydroxy-2-(2-oxo-1H-naphthalen-1-yl)heptanoic acid IUPAC Name: 2-(2,2-dimethylbutanoyl)-3,5-dihydroxy-2-(2-oxo-1H-naphthalen-1-yl)heptanoic acid Traditional Name: 2-(2,2-dimethylbutanoyl)-3,5-dihydroxy-2-(2-keto-1H-naphthalen-1-yl)enanthic acid Formula: C23H30O6 MolecularWeight: 402.4807

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(C1C(=O)C=CC2=CC=CC=C12)(C(=O)C(C)(C)CC)C(=O)O)O)O

Isomeric SMILES

CCC(CC(C(C1C(=O)C=CC2=CC=CC=C12)(C(=O)C(C)(C)CC)C(=O)O)O)O

InChI

InChI=1S/C23H30O6/c1-5-15(24)13-18(26)23(21(28)29,20(27)22(3,4)6-2)19-16-10-8-7-9-14(16)11-12-17(19)25/h7-12,15,18-19,24,26H,5-6,13H2,1-4H3,(H,28,29)