(2S,6S,7R)-2-methyl-6-oxidanyl-7-propan-2-yl-oxepane-2-carbonitrile

Systemtic Name: (2S,6S,7R)-2-methyl-6-oxidanyl-7-propan-2-yl-oxepane-2-carbonitrile Openeye Name: (2S,6S,7R)-6-hydroxy-7-isopropyl-2-methyl-oxepane-2-carbonitrile CAS Name: (2S,6S,7R)-6-hydroxy-2-methyl-7-propan-2-yl-2-oxepanecarbonitrile IUPAC Name: (2S,6S,7R)-6-hydroxy-2-methyl-7-propan-2-yloxepane-2-carbonitrile Traditional Name: (2S,6S,7R)-6-hydroxy-7-isopropyl-2-methyl-oxepane-2-carbonitrile Formula: C11H19NO2 MolecularWeight: 197.27406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(CCCC(O1)(C)C#N)O

Isomeric SMILES

CC(C)[C@@H]1[C@H](CCC[C@@](O1)(C)C#N)O

InChI

InChI=1S/C11H19NO2/c1-8(2)10-9(13)5-4-6-11(3,7-12)14-10/h8-10,13H,4-6H2,1-3H3/t9-,10+,11-/m0/s1