2,6,6-trimethyl-3-oxidanylidene-cyclohexene-1-carbonitrile

Systemtic Name: 2,6,6-trimethyl-3-oxidanylidene-cyclohexene-1-carbonitrile Openeye Name: 2,6,6-trimethyl-3-oxo-cyclohexene-1-carbonitrile CAS Name: 2,6,6-trimethyl-3-oxo-1-cyclohexenecarbonitrile IUPAC Name: 2,6,6-trimethyl-3-oxocyclohexene-1-carbonitrile Traditional Name: 3-keto-2,6,6-trimethyl-cyclohexene-1-carbonitrile Formula: C10H13NO MolecularWeight: 163.21632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1=O)(C)C)C#N

Isomeric SMILES

CC1=C(C(CCC1=O)(C)C)C#N

InChI

InChI=1S/C10H13NO/c1-7-8(6-11)10(2,3)5-4-9(7)12/h4-5H2,1-3H3