2-[2-[(1R,2R)-2-methylcyclohexyl]-1-phenyl-ethyl]propanedinitrile

Systemtic Name: 2-[2-[(1R,2R)-2-methylcyclohexyl]-1-phenyl-ethyl]propanedinitrile Openeye Name: 2-[2-[(1R,2R)-2-methylcyclohexyl]-1-phenyl-ethyl]propanedinitrile CAS Name: 2-[2-[(1R,2R)-2-methylcyclohexyl]-1-phenylethyl]propanedinitrile IUPAC Name: 2-[2-[(1R,2R)-2-methylcyclohexyl]-1-phenylethyl]propanedinitrile Traditional Name: 2-[2-[(1R,2R)-2-methylcyclohexyl]-1-phenyl-ethyl]malononitrile Formula: C18H22N2 MolecularWeight: 266.38068

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1CC(C2=CC=CC=C2)C(C#N)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2/c1-14-7-5-6-10-16(14)11-18(17(12-19)13-20)15-8-3-2-4-9-15/h2-4,8-9,14,16-18H,5-7,10-11H2,1H3/t14-,16-,18?/m1/s1