4-methyl-5-oxidanyl-7-oxidanylidene-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile

Systemtic Name: 4-methyl-5-oxidanyl-7-oxidanylidene-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Openeye Name: 5-hydroxy-4-methyl-7-oxo-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile CAS Name: 5-hydroxy-4-methyl-7-oxo-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile IUPAC Name: 5-hydroxy-4-methyl-7-oxo-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Traditional Name: 5-hydroxy-7-keto-4-methyl-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile Formula: C17H14N4O2 MolecularWeight: 306.31866

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C2(CC1(NC2=O)O)C#N)(C#N)C#N)C3=CC=CC=C3

Isomeric SMILES

CC1C(C(C2(CC1(NC2=O)O)C#N)(C#N)C#N)C3=CC=CC=C3

InChI

InChI=1S/C17H14N4O2/c1-11-13(12-5-3-2-4-6-12)16(9-19,10-20)15(8-18)7-17(11,23)21-14(15)22/h2-6,11,13,23H,7H2,1H3,(H,21,22)