2-[(1S,2S,5S)-2-methyl-3-oxidanylidene-5-prop-1-en-2-yl-cyclohexyl]ethanenitrile

Systemtic Name: 2-[(1S,2S,5S)-2-methyl-3-oxidanylidene-5-prop-1-en-2-yl-cyclohexyl]ethanenitrile Openeye Name: 2-[(1S,2S,5S)-5-isopropenyl-2-methyl-3-oxo-cyclohexyl]acetonitrile CAS Name: 2-[(1S,2S,5S)-2-methyl-5-(1-methylethenyl)-3-oxocyclohexyl]acetonitrile IUPAC Name: 2-[(1S,2S,5S)-2-methyl-3-oxo-5-prop-1-en-2-ylcyclohexyl]acetonitrile Traditional Name: 2-[(1S,2S,5S)-5-isopropenyl-3-keto-2-methyl-cyclohexyl]acetonitrile Formula: C12H17NO MolecularWeight: 191.26948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO/c1-8(2)11-6-10(4-5-13)9(3)12(14)7-11/h9-11H,1,4,6-7H2,2-3H3/t9-,10+,11-/m0/s1