3-butyl-1-oxidanyl-6-oxidanylidene-7-azabicyclo[3.2.1]octane-4,4,5-tricarbonitrile

Systemtic Name: 3-butyl-1-oxidanyl-6-oxidanylidene-7-azabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Openeye Name: 3-butyl-1-hydroxy-6-oxo-7-azabicyclo[3.2.1]octane-4,4,5-tricarbonitrile CAS Name: 3-butyl-1-hydroxy-6-oxo-7-azabicyclo[3.2.1]octane-4,4,5-tricarbonitrile IUPAC Name: 3-butyl-1-hydroxy-6-oxo-7-azabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Traditional Name: 3-butyl-1-hydroxy-6-keto-7-azabicyclo[3.2.1]octane-4,4,5-tricarbonitrile Formula: C14H16N4O2 MolecularWeight: 272.30244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC2(CC(C1(C#N)C#N)(C(=O)N2)C#N)O

Isomeric SMILES

CCCCC1CC2(CC(C1(C#N)C#N)(C(=O)N2)C#N)O

InChI

InChI=1S/C14H16N4O2/c1-2-3-4-10-5-14(20)6-12(7-15,11(19)18-14)13(10,8-16)9-17/h10,20H,2-6H2,1H3,(H,18,19)