3-[1,4,4-trimethyl-2,6-bis(oxidanylidene)cyclohexyl]propanenitrile

Systemtic Name: 3-[1,4,4-trimethyl-2,6-bis(oxidanylidene)cyclohexyl]propanenitrile Openeye Name: 3-(1,4,4-trimethyl-2,6-dioxo-cyclohexyl)propanenitrile CAS Name: 3-(1,4,4-trimethyl-2,6-dioxocyclohexyl)propanenitrile IUPAC Name: 3-(1,4,4-trimethyl-2,6-dioxocyclohexyl)propanenitrile Traditional Name: 3-(2,6-diketo-1,4,4-trimethyl-cyclohexyl)propionitrile Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)(C)CCC#N)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)(C)CCC#N)C

InChI

InChI=1S/C12H17NO2/c1-11(2)7-9(14)12(3,5-4-6-13)10(15)8-11/h4-5,7-8H2,1-3H3