2-[(3,5-ditert-butylphenyl)methyl]cyclohexan-1-one

Systemtic Name: 2-[(3,5-ditert-butylphenyl)methyl]cyclohexan-1-one Openeye Name: 2-[(3,5-ditert-butylphenyl)methyl]cyclohexanone CAS Name: 2-[(3,5-ditert-butylphenyl)methyl]-1-cyclohexanone IUPAC Name: 2-[(3,5-ditert-butylphenyl)methyl]cyclohexan-1-one Traditional Name: 2-(3,5-ditert-butylbenzyl)cyclohexanone Formula: C21H32O MolecularWeight: 300.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)CC2CCCCC2=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)CC2CCCCC2=O)C(C)(C)C

InChI

InChI=1S/C21H32O/c1-20(2,3)17-12-15(13-18(14-17)21(4,5)6)11-16-9-7-8-10-19(16)22/h12-14,16H,7-11H2,1-6H3