4-methyl-3-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]cycloheptan-1-one

Systemtic Name: 4-methyl-3-[4-(2-methyloctan-2-yl)-2-oxidanyl-phenyl]cycloheptan-1-one Openeye Name: 3-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]-4-methyl-cycloheptanone CAS Name: 3-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]-4-methyl-1-cycloheptanone IUPAC Name: 3-[2-hydroxy-4-(2-methyloctan-2-yl)phenyl]-4-methylcycloheptan-1-one Traditional Name: 3-[4-(1,1-dimethylheptyl)-2-hydroxy-phenyl]-4-methyl-cycloheptanone Formula: C23H36O2 MolecularWeight: 344.53074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(=O)CCCC2C)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(=O)CCCC2C)O

InChI

InChI=1S/C23H36O2/c1-5-6-7-8-14-23(3,4)18-12-13-20(22(25)15-18)21-16-19(24)11-9-10-17(21)2/h12-13,15,17,21,25H,5-11,14,16H2,1-4H3