2-[(1R,2R)-2-[(2S)-3-bromanyl-2-oxidanyl-propyl]-2-methyl-cyclohexyl]propanedinitrile

Systemtic Name: 2-[(1R,2R)-2-[(2S)-3-bromanyl-2-oxidanyl-propyl]-2-methyl-cyclohexyl]propanedinitrile Openeye Name: 2-[(1R,2R)-2-[(2S)-3-bromo-2-hydroxy-propyl]-2-methyl-cyclohexyl]propanedinitrile CAS Name: 2-[(1R,2R)-2-[(2S)-3-bromo-2-hydroxypropyl]-2-methylcyclohexyl]propanedinitrile IUPAC Name: 2-[(1R,2R)-2-[(2S)-3-bromo-2-hydroxypropyl]-2-methylcyclohexyl]propanedinitrile Traditional Name: 2-[(1R,2R)-2-[(2S)-3-bromo-2-hydroxy-propyl]-2-methyl-cyclohexyl]malononitrile Formula: C13H19BrN2O MolecularWeight: 299.20676

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1C(C#N)C#N)CC(CBr)O

Isomeric SMILES

C[C@@]1(CCCC[C@@H]1C(C#N)C#N)C[C@@H](CBr)O

InChI

InChI=1S/C13H19BrN2O/c1-13(6-11(17)7-14)5-3-2-4-12(13)10(8-15)9-16/h10-12,17H,2-7H2,1H3/t11-,12+,13+/m0/s1