1-oxidanidyl-6-phenyl-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 1-oxidanidyl-6-phenyl-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 1-oxido-6-phenyl-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 1-oxido-6-phenyl-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 1-oxido-6-phenyl-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (1-oxido-6-phenyl-1,2,4-benzotriazin-1-ium-3-yl)amine Formula: C13H10N4O MolecularWeight: 238.2447

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)[N+](=NC(=N3)N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)[N+](=NC(=N3)N)[O-]

InChI

InChI=1S/C13H10N4O/c14-13-15-11-8-10(9-4-2-1-3-5-9)6-7-12(11)17(18)16-13/h1-8H,(H2,14,15,16)