1-oxidanidyl-N-quinolin-3-yl-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 1-oxidanidyl-N-quinolin-3-yl-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 1-oxido-N-(3-quinolyl)-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 1-oxido-N-(3-quinolinyl)-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 1-oxido-N-quinolin-3-yl-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (1-oxido-1,2,4-benzotriazin-1-ium-3-yl)-(3-quinolyl)amine Formula: C16H11N5O MolecularWeight: 289.29144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC3=NC4=CC=CC=C4[N+](=N3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC3=NC4=CC=CC=C4[N+](=N3)[O-]

InChI

InChI=1S/C16H11N5O/c22-21-15-8-4-3-7-14(15)19-16(20-21)18-12-9-11-5-1-2-6-13(11)17-10-12/h1-10H,(H,18,19,20)