[(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] thiocyanate

Systemtic Name: [(1S,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] thiocyanate Openeye Name: [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] thiocyanate CAS Name: thiocyanic acid [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] thiocyanate Traditional Name: thiocyanic acid [(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C11H19NS MolecularWeight: 197.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)SC#N)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@H](C1)SC#N)C(C)C

InChI

InChI=1S/C11H19NS/c1-8(2)10-5-4-9(3)6-11(10)13-7-12/h8-11H,4-6H2,1-3H3/t9-,10+,11+/m1/s1