2-[2-[2-(bromomethyl)-3,4-dimethoxy-5-propan-2-yl-phenyl]ethyl]-3,3-dimethyl-cyclohexan-1-one

Systemtic Name: 2-[2-[2-(bromomethyl)-3,4-dimethoxy-5-propan-2-yl-phenyl]ethyl]-3,3-dimethyl-cyclohexan-1-one Openeye Name: 2-[2-[2-(bromomethyl)-5-isopropyl-3,4-dimethoxy-phenyl]ethyl]-3,3-dimethyl-cyclohexanone CAS Name: 2-[2-[2-(bromomethyl)-3,4-dimethoxy-5-propan-2-ylphenyl]ethyl]-3,3-dimethyl-1-cyclohexanone IUPAC Name: 2-[2-[2-(bromomethyl)-3,4-dimethoxy-5-propan-2-ylphenyl]ethyl]-3,3-dimethylcyclohexan-1-one Traditional Name: 2-[2-[2-(bromomethyl)-5-isopropyl-3,4-dimethoxy-phenyl]ethyl]-3,3-dimethyl-cyclohexanone Formula: C22H33BrO3 MolecularWeight: 425.39962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C(=C1)CCC2C(=O)CCCC2(C)C)CBr)OC)OC

Isomeric SMILES

CC(C)C1=C(C(=C(C(=C1)CCC2C(=O)CCCC2(C)C)CBr)OC)OC

InChI

InChI=1S/C22H33BrO3/c1-14(2)16-12-15(17(13-23)21(26-6)20(16)25-5)9-10-18-19(24)8-7-11-22(18,3)4/h12,14,18H,7-11,13H2,1-6H3