2,2,2-trideuterio-1-(3,5-ditert-butylphenyl)ethanone

Systemtic Name: 2,2,2-trideuterio-1-(3,5-ditert-butylphenyl)ethanone Openeye Name: 2,2,2-trideuterio-1-(3,5-ditert-butylphenyl)ethanone CAS Name: 2,2,2-trideuterio-1-(3,5-ditert-butylphenyl)ethanone IUPAC Name: 2,2,2-trideuterio-1-(3,5-ditert-butylphenyl)ethanone Traditional Name: 2,2,2-trideuterio-1-(3,5-ditert-butylphenyl)ethanone Formula: C16H24O MolecularWeight: 236.3723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H][13C]([2H])([2H])C(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C16H24O/c1-11(17)12-8-13(15(2,3)4)10-14(9-12)16(5,6)7/h8-10H,1-7H3/i1+1D3