2-[1,3-benzodioxol-5-yl-(2-methoxy-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-[1,3-benzodioxol-5-yl-(2-methoxy-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 2-[1,3-benzodioxol-5-yl-(2-methoxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)methyl]-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-[1,3-benzodioxol-5-yl-(2-methoxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)methyl]-3-methoxy-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-[1,3-benzodioxol-5-yl-(2-methoxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-3-methoxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-[1,3-benzodioxol-5-yl-(6-keto-2-methoxy-4,4-dimethyl-cyclohexen-1-yl)methyl]-3-methoxy-5,5-dimethyl-cyclohex-2-en-1-one Formula: C26H32O6 MolecularWeight: 440.52868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(C2=CC3=C(C=C2)OCO3)C4=C(CC(CC4=O)(C)C)OC)OC)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(C2=CC3=C(C=C2)OCO3)C4=C(CC(CC4=O)(C)C)OC)OC)C

InChI

InChI=1S/C26H32O6/c1-25(2)10-16(27)23(20(12-25)29-5)22(15-7-8-18-19(9-15)32-14-31-18)24-17(28)11-26(3,4)13-21(24)30-6/h7-9,22H,10-14H2,1-6H3