2-[(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-(3-phenoxyphenyl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-(3-phenoxyphenyl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-(3-phenoxyphenyl)methyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-(3-phenoxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(3-phenoxyphenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-(3-phenoxyphenyl)methyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C29H32O5 MolecularWeight: 460.56138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=C(CC(CC4=O)(C)C)O)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)C4=C(CC(CC4=O)(C)C)O)C

InChI

InChI=1S/C29H32O5/c1-28(2)14-21(30)26(22(31)15-28)25(27-23(32)16-29(3,4)17-24(27)33)18-9-8-12-20(13-18)34-19-10-6-5-7-11-19/h5-13,25-26,32H,14-17H2,1-4H3