[2-(3,3-dimethyl-2-oxidanylidene-butanoyl)-2-(2,2-dimethylpropanoyl)-4-oxidanylidene-3-phenyl-oxetan-3-yl] benzoate

Systemtic Name: [2-(3,3-dimethyl-2-oxidanylidene-butanoyl)-2-(2,2-dimethylpropanoyl)-4-oxidanylidene-3-phenyl-oxetan-3-yl] benzoate Openeye Name: [2-(3,3-dimethyl-2-oxo-butanoyl)-2-(2,2-dimethylpropanoyl)-4-oxo-3-phenyl-oxetan-3-yl] benzoate CAS Name: benzoic acid [2-(3,3-dimethyl-1,2-dioxobutyl)-2-(2,2-dimethyl-1-oxopropyl)-4-oxo-3-phenyl-3-oxetanyl] ester IUPAC Name: [2-(3,3-dimethyl-2-oxobutanoyl)-2-(2,2-dimethylpropanoyl)-4-oxo-3-phenyloxetan-3-yl] benzoate Traditional Name: benzoic acid [4-keto-2-(2-keto-3,3-dimethyl-butanoyl)-3-phenyl-2-pivaloyl-oxetan-3-yl] ester Formula: C27H28O7 MolecularWeight: 464.50702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=O)C1(C(C(=O)O1)(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C(=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)C(=O)C1(C(C(=O)O1)(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C(=O)C(C)(C)C

InChI

InChI=1S/C27H28O7/c1-24(2,3)19(28)20(29)27(22(31)25(4,5)6)26(23(32)34-27,18-15-11-8-12-16-18)33-21(30)17-13-9-7-10-14-17/h7-16H,1-6H3