methyl 3,3-bis(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-2-phenyl-propanoate

Systemtic Name: methyl 3,3-bis(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-2-phenyl-propanoate Openeye Name: methyl 3,3-bis(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-2-phenyl-propanoate CAS Name: 3,3-bis(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-2-phenylpropanoic acid methyl ester IUPAC Name: methyl 3,3-bis(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-2-phenylpropanoate Traditional Name: 3,3-bis(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-2-phenyl-propionic acid methyl ester Formula: C26H32O6 MolecularWeight: 440.52868

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(C2=C(CC(CC2=O)(C)C)O)C(C3=CC=CC=C3)C(=O)OC)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(C2=C(CC(CC2=O)(C)C)O)C(C3=CC=CC=C3)C(=O)OC)O)C

InChI

InChI=1S/C26H32O6/c1-25(2)11-16(27)21(17(28)12-25)23(22-18(29)13-26(3,4)14-19(22)30)20(24(31)32-5)15-9-7-6-8-10-15/h6-10,20,23,27,29H,11-14H2,1-5H3