3-[(1R,2S,4R)-4-tert-butyl-2-methyl-cyclohexyl]butanenitrile

Systemtic Name: 3-[(1R,2S,4R)-4-tert-butyl-2-methyl-cyclohexyl]butanenitrile Openeye Name: 3-[(1R,2S,4R)-4-tert-butyl-2-methyl-cyclohexyl]butanenitrile CAS Name: 3-[(1R,2S,4R)-4-tert-butyl-2-methylcyclohexyl]butanenitrile IUPAC Name: 3-[(1R,2S,4R)-4-tert-butyl-2-methylcyclohexyl]butanenitrile Traditional Name: 3-[(1R,2S,4R)-4-tert-butyl-2-methyl-cyclohexyl]butyronitrile Formula: C15H27N MolecularWeight: 221.38158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCC1C(C)CC#N)C(C)(C)C

Isomeric SMILES

C[C@H]1C[C@@H](CC[C@H]1C(C)CC#N)C(C)(C)C

InChI

InChI=1S/C15H27N/c1-11(8-9-16)14-7-6-13(10-12(14)2)15(3,4)5/h11-14H,6-8,10H2,1-5H3/t11?,12-,13+,14-/m0/s1