4,7-dimethyl-3-oxidanylidene-2-phenyl-1,2,4-benzotriazin-4-ium-5-carbonitrile

Systemtic Name: 4,7-dimethyl-3-oxidanylidene-2-phenyl-1,2,4-benzotriazin-4-ium-5-carbonitrile Openeye Name: 4,7-dimethyl-3-oxo-2-phenyl-1,2,4-benzotriazin-4-ium-5-carbonitrile CAS Name: 4,7-dimethyl-3-oxo-2-phenyl-1,2,4-benzotriazin-4-ium-5-carbonitrile IUPAC Name: 4,7-dimethyl-3-oxo-2-phenyl-1,2,4-benzotriazin-4-ium-5-carbonitrile Traditional Name: 3-keto-4,7-dimethyl-2-phenyl-1,2,4-benzotriazin-4-ium-5-carbonitrile Formula: C16H13N4O+ MolecularWeight: 277.30062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(C(=O)[N+](=C2C(=C1)C#N)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=NN(C(=O)[N+](=C2C(=C1)C#N)C)C3=CC=CC=C3

InChI

InChI=1S/C16H13N4O/c1-11-8-12(10-17)15-14(9-11)18-20(16(21)19(15)2)13-6-4-3-5-7-13/h3-9H,1-2H3/q+1