(1R,2S)-3,3,5,5-tetradeuterio-2-methyl-4-oxidanylidene-cyclohexane-1-carbonitrile

Systemtic Name: (1R,2S)-3,3,5,5-tetradeuterio-2-methyl-4-oxidanylidene-cyclohexane-1-carbonitrile Openeye Name: (1R,2S)-3,3,5,5-tetradeuterio-2-methyl-4-oxo-cyclohexanecarbonitrile CAS Name: (1R,2S)-3,3,5,5-tetradeuterio-2-methyl-4-oxo-1-cyclohexanecarbonitrile IUPAC Name: (1R,2S)-3,3,5,5-tetradeuterio-2-methyl-4-oxocyclohexane-1-carbonitrile Traditional Name: (1R,2S)-3,3,5,5-tetradeuterio-4-keto-2-methyl-cyclohexanecarbonitrile Formula: C8H11NO MolecularWeight: 141.203687

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)CCC1C#N

Isomeric SMILES

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

InChI

InChI=1S/C8H11NO/c1-6-4-8(10)3-2-7(6)5-9/h6-7H,2-4H2,1H3/t6-,7-/m0/s1/i3D2,4D2