4-(2-oxidanylidene-1,3-diazinan-1-yl)benzenecarbonitrile

Systemtic Name: 4-(2-oxidanylidene-1,3-diazinan-1-yl)benzenecarbonitrile Openeye Name: 4-(2-oxohexahydropyrimidin-1-yl)benzonitrile CAS Name: 4-(2-oxo-1,3-diazinan-1-yl)benzonitrile IUPAC Name: 4-(2-oxo-1,3-diazinan-1-yl)benzonitrile Traditional Name: 4-(2-ketohexahydropyrimidin-1-yl)benzonitrile Formula: C11H11N3O MolecularWeight: 201.22454

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)N(C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CNC(=O)N(C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C11H11N3O/c12-8-9-2-4-10(5-3-9)14-7-1-6-13-11(14)15/h2-5H,1,6-7H2,(H,13,15)