2-[(R)-(4-dimethylaminophenyl)-[(1R)-1-methyl-2-oxidanylidene-cyclohexyl]methyl]-2-prop-2-enyl-propanedinitrile

Systemtic Name: 2-[(R)-(4-dimethylaminophenyl)-[(1R)-1-methyl-2-oxidanylidene-cyclohexyl]methyl]-2-prop-2-enyl-propanedinitrile Openeye Name: 2-allyl-2-[(R)-(4-dimethylaminophenyl)-[(1R)-1-methyl-2-oxo-cyclohexyl]methyl]propanedinitrile CAS Name: 2-[(R)-(4-dimethylaminophenyl)-[(1R)-1-methyl-2-oxocyclohexyl]methyl]-2-prop-2-enylpropanedinitrile IUPAC Name: 2-[(R)-(4-dimethylaminophenyl)-[(1R)-1-methyl-2-oxocyclohexyl]methyl]-2-prop-2-enylpropanedinitrile Traditional Name: 2-allyl-2-[(R)-(4-dimethylaminophenyl)-[(1R)-2-keto-1-methyl-cyclohexyl]methyl]malononitrile Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1=O)C(C2=CC=C(C=C2)N(C)C)C(CC=C)(C#N)C#N

Isomeric SMILES

C[C@@]1(CCCCC1=O)[C@H](C2=CC=C(C=C2)N(C)C)C(CC=C)(C#N)C#N

InChI

InChI=1S/C22H27N3O/c1-5-13-22(15-23,16-24)20(21(2)14-7-6-8-19(21)26)17-9-11-18(12-10-17)25(3)4/h5,9-12,20H,1,6-8,13-14H2,2-4H3/t20-,21-/m0/s1