2,2-dimethyl-6-oxidanyl-1,3-dioxepane-5-carbonitrile

Systemtic Name: 2,2-dimethyl-6-oxidanyl-1,3-dioxepane-5-carbonitrile Openeye Name: 6-hydroxy-2,2-dimethyl-1,3-dioxepane-5-carbonitrile CAS Name: 6-hydroxy-2,2-dimethyl-1,3-dioxepane-5-carbonitrile IUPAC Name: 6-hydroxy-2,2-dimethyl-1,3-dioxepane-5-carbonitrile Traditional Name: 6-hydroxy-2,2-dimethyl-1,3-dioxepane-5-carbonitrile Formula: C8H13NO3 MolecularWeight: 171.19372

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(CO1)O)C#N)C

Isomeric SMILES

CC1(OCC(C(CO1)O)C#N)C

InChI

InChI=1S/C8H13NO3/c1-8(2)11-4-6(3-9)7(10)5-12-8/h6-7,10H,4-5H2,1-2H3