2-[(2-oxidanylidene-5-phenyl-3,6-dihydro-1,3,4-oxadiazin-6-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(2-oxidanylidene-5-phenyl-3,6-dihydro-1,3,4-oxadiazin-6-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(2-oxo-5-phenyl-3,6-dihydro-1,3,4-oxadiazin-6-yl)methyl]benzonitrile CAS Name: 2-[(2-oxo-5-phenyl-3,6-dihydro-1,3,4-oxadiazin-6-yl)methyl]benzonitrile IUPAC Name: 2-[(2-oxo-5-phenyl-3,6-dihydro-1,3,4-oxadiazin-6-yl)methyl]benzonitrile Traditional Name: 2-[(2-keto-5-phenyl-3,6-dihydro-1,3,4-oxadiazin-6-yl)methyl]benzonitrile Formula: C17H13N3O2 MolecularWeight: 291.30402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=O)OC2CC3=CC=CC=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=O)OC2CC3=CC=CC=C3C#N

InChI

InChI=1S/C17H13N3O2/c18-11-14-9-5-4-8-13(14)10-15-16(19-20-17(21)22-15)12-6-2-1-3-7-12/h1-9,15H,10H2,(H,20,21)