(1S,2S,5S)-2-methyl-3-oxidanylidene-5-(2-oxidanylpropan-2-yl)cyclohexane-1-carbonitrile

Systemtic Name: (1S,2S,5S)-2-methyl-3-oxidanylidene-5-(2-oxidanylpropan-2-yl)cyclohexane-1-carbonitrile Openeye Name: (1S,2S,5S)-5-(1-hydroxy-1-methyl-ethyl)-2-methyl-3-oxo-cyclohexanecarbonitrile CAS Name: (1S,2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyl-3-oxo-1-cyclohexanecarbonitrile IUPAC Name: (1S,2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyl-3-oxocyclohexane-1-carbonitrile Traditional Name: (1S,2S,5S)-5-(1-hydroxy-1-methyl-ethyl)-3-keto-2-methyl-cyclohexanecarbonitrile Formula: C11H17NO2 MolecularWeight: 195.25818

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(CC1=O)C(C)(C)O)C#N

Isomeric SMILES

C[C@H]1[C@H](C[C@@H](CC1=O)C(C)(C)O)C#N

InChI

InChI=1S/C11H17NO2/c1-7-8(6-12)4-9(5-10(7)13)11(2,3)14/h7-9,14H,4-5H2,1-3H3/t7-,8+,9-/m0/s1