2-[(1R,3S,6S)-6-(methoxymethoxy)-2,2,6-trimethyl-3-oxidanyl-cyclohexyl]-2-oxidanyl-ethanenitrile

Systemtic Name: 2-[(1R,3S,6S)-6-(methoxymethoxy)-2,2,6-trimethyl-3-oxidanyl-cyclohexyl]-2-oxidanyl-ethanenitrile Openeye Name: 2-hydroxy-2-[(1R,3S,6S)-3-hydroxy-6-(methoxymethoxy)-2,2,6-trimethyl-cyclohexyl]acetonitrile CAS Name: 2-hydroxy-2-[(1R,3S,6S)-3-hydroxy-6-(methoxymethoxy)-2,2,6-trimethylcyclohexyl]acetonitrile IUPAC Name: 2-hydroxy-2-[(1R,3S,6S)-3-hydroxy-6-(methoxymethoxy)-2,2,6-trimethylcyclohexyl]acetonitrile Traditional Name: 2-hydroxy-2-[(1R,3S,6S)-3-hydroxy-6-(methoxymethoxy)-2,2,6-trimethyl-cyclohexyl]acetonitrile Formula: C13H23NO4 MolecularWeight: 257.32602

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC(C1C(C#N)O)(C)OCOC)O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H23NO4/c1-12(2)10(16)5-6-13(3,18-8-17-4)11(12)9(15)7-14/h9-11,15-16H,5-6,8H2,1-4H3/t9?,10-,11-,13-/m0/s1