(1S,2S)-2-tert-butyl-3,3,5,5-tetradeuterio-4-oxidanylidene-cyclohexane-1-carbonitrile

Systemtic Name: (1S,2S)-2-tert-butyl-3,3,5,5-tetradeuterio-4-oxidanylidene-cyclohexane-1-carbonitrile Openeye Name: (1S,2S)-2-tert-butyl-3,3,5,5-tetradeuterio-4-oxo-cyclohexanecarbonitrile CAS Name: (1S,2S)-2-tert-butyl-3,3,5,5-tetradeuterio-4-oxo-1-cyclohexanecarbonitrile IUPAC Name: (1S,2S)-2-tert-butyl-3,3,5,5-tetradeuterio-4-oxocyclohexane-1-carbonitrile Traditional Name: (1S,2S)-2-tert-butyl-3,3,5,5-tetradeuterio-4-keto-cyclohexanecarbonitrile Formula: C11H17NO MolecularWeight: 183.283427

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(=O)CCC1C#N

Isomeric SMILES

[2H]C1(C[C@@H]([C@H](C(C1=O)([2H])[2H])C(C)(C)C)C#N)[2H]

InChI

InChI=1S/C11H17NO/c1-11(2,3)10-6-9(13)5-4-8(10)7-12/h8,10H,4-6H2,1-3H3/t8-,10+/m1/s1/i5D2,6D2