(1S,3S,4R,6S)-3,4-dimethyl-2-oxidanylidene-1-(3-oxidanylidenebutyl)-6-prop-1-en-2-yl-cyclohexane-1-carbonitrile

Systemtic Name: (1S,3S,4R,6S)-3,4-dimethyl-2-oxidanylidene-1-(3-oxidanylidenebutyl)-6-prop-1-en-2-yl-cyclohexane-1-carbonitrile Openeye Name: (1S,3S,4R,6S)-6-isopropenyl-3,4-dimethyl-2-oxo-1-(3-oxobutyl)cyclohexanecarbonitrile CAS Name: (1S,3S,4R,6S)-3,4-dimethyl-6-(1-methylethenyl)-2-oxo-1-(3-oxobutyl)-1-cyclohexanecarbonitrile IUPAC Name: (1S,3S,4R,6S)-3,4-dimethyl-2-oxo-1-(3-oxobutyl)-6-prop-1-en-2-ylcyclohexane-1-carbonitrile Traditional Name: (1S,3S,4R,6S)-6-isopropenyl-2-keto-1-(3-ketobutyl)-3,4-dimethyl-cyclohexanecarbonitrile Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(=O)C1C)(CCC(=O)C)C#N)C(=C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO2/c1-10(2)14-8-11(3)13(5)15(19)16(14,9-17)7-6-12(4)18/h11,13-14H,1,6-8H2,2-5H3/t11-,13+,14+,16-/m1/s1