4,5,7-trimethyl-2-phenyl-3H-1,2,4-benzotriazine-2,4-diium-4-carbonitrile

Systemtic Name: 4,5,7-trimethyl-2-phenyl-3H-1,2,4-benzotriazine-2,4-diium-4-carbonitrile Openeye Name: 4,5,7-trimethyl-2-phenyl-3H-1,2,4-benzotriazine-2,4-diium-4-carbonitrile CAS Name: 4,5,7-trimethyl-2-phenyl-3H-1,2,4-benzotriazine-2,4-diium-4-carbonitrile IUPAC Name: 4,5,7-trimethyl-2-phenyl-3H-1,2,4-benzotriazine-2,4-diium-4-carbonitrile Traditional Name: 4,5,7-trimethyl-2-phenyl-3H-1,2,4-benzotriazine-2,4-diium-4-carbonitrile Formula: C17H18N4+2 MolecularWeight: 278.35162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=[N+](C[N+]2(C)C#N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=[N+](C[N+]2(C)C#N)C3=CC=CC=C3)C

InChI

InChI=1S/C17H18N4/c1-13-9-14(2)17-16(10-13)19-20(12-21(17,3)11-18)15-7-5-4-6-8-15/h4-10H,12H2,1-3H3/q+2