3-(4-methylphenyl)-1H-4,1,2-benzoxadiazine-6,7-dicarbonitrile

Systemtic Name: 3-(4-methylphenyl)-1H-4,1,2-benzoxadiazine-6,7-dicarbonitrile Openeye Name: 3-(p-tolyl)-1H-4,1,2-benzoxadiazine-6,7-dicarbonitrile CAS Name: 3-(4-methylphenyl)-1H-4,1,2-benzoxadiazine-6,7-dicarbonitrile IUPAC Name: 3-(4-methylphenyl)-1H-4,1,2-benzoxadiazine-6,7-dicarbonitrile Traditional Name: 3-(p-tolyl)-1H-4,1,2-benzoxadiazine-6,7-dicarbonitrile Formula: C16H10N4O MolecularWeight: 274.2768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC3=C(O2)C=C(C(=C3)C#N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC3=C(O2)C=C(C(=C3)C#N)C#N

InChI

InChI=1S/C16H10N4O/c1-10-2-4-11(5-3-10)16-20-19-14-6-12(8-17)13(9-18)7-15(14)21-16/h2-7,19H,1H3