(1S,2R,3S)-2,3-dimethyl-3-oxidanyl-cycloheptane-1-carbonitrile

Systemtic Name: (1S,2R,3S)-2,3-dimethyl-3-oxidanyl-cycloheptane-1-carbonitrile Openeye Name: (1S,2R,3S)-3-hydroxy-2,3-dimethyl-cycloheptanecarbonitrile CAS Name: (1S,2R,3S)-3-hydroxy-2,3-dimethyl-1-cycloheptanecarbonitrile IUPAC Name: (1S,2R,3S)-3-hydroxy-2,3-dimethylcycloheptane-1-carbonitrile Traditional Name: (1S,2R,3S)-3-hydroxy-2,3-dimethyl-cycloheptanecarbonitrile Formula: C10H17NO MolecularWeight: 167.24808

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCCCC1(C)O)C#N

Isomeric SMILES

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

InChI

InChI=1S/C10H17NO/c1-8-9(7-11)5-3-4-6-10(8,2)12/h8-9,12H,3-6H2,1-2H3/t8-,9-,10+/m1/s1