(4S,5R)-4-methyl-5-oxidanyl-decanenitrile

Systemtic Name: (4S,5R)-4-methyl-5-oxidanyl-decanenitrile Openeye Name: (4S,5R)-5-hydroxy-4-methyl-decanenitrile CAS Name: (4S,5R)-5-hydroxy-4-methyldecanenitrile IUPAC Name: (4S,5R)-5-hydroxy-4-methyldecanenitrile Traditional Name: (4S,5R)-5-hydroxy-4-methyl-capronitrile Formula: C11H21NO MolecularWeight: 183.29054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C)CCC#N)O

Isomeric SMILES

CCCCC[C@H]([C@@H](C)CCC#N)O

InChI

InChI=1S/C11H21NO/c1-3-4-5-8-11(13)10(2)7-6-9-12/h10-11,13H,3-8H2,1-2H3/t10-,11+/m0/s1