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

Systemtic Name: 3-(3-oxidanylidene-4-phenyl-1,2-diazinan-1-yl)benzenecarbonitrile Openeye Name: 3-(3-oxo-4-phenyl-hexahydropyridazin-1-yl)benzonitrile CAS Name: 3-(3-oxo-4-phenyl-1-diazinanyl)benzonitrile IUPAC Name: 3-(3-oxo-4-phenyldiazinan-1-yl)benzonitrile Traditional Name: 3-(3-keto-4-phenyl-hexahydropyridazin-1-yl)benzonitrile Formula: C17H15N3O MolecularWeight: 277.3205

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(NC(=O)C1C2=CC=CC=C2)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(NC(=O)C1C2=CC=CC=C2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H15N3O/c18-12-13-5-4-8-15(11-13)20-10-9-16(17(21)19-20)14-6-2-1-3-7-14/h1-8,11,16H,9-10H2,(H,19,21)