N-butyl-4-oxidanidyl-[1,2,4]triazino[6,5-c]quinolin-4-ium-2-amine

Systemtic Name: N-butyl-4-oxidanidyl-[1,2,4]triazino[6,5-c]quinolin-4-ium-2-amine Openeye Name: N-butyl-4-oxido-[1,2,4]triazino[6,5-c]quinolin-4-ium-2-amine CAS Name: N-butyl-4-oxido-[1,2,4]triazino[6,5-c]quinolin-4-ium-2-amine IUPAC Name: N-butyl-4-oxido-[1,2,4]triazino[6,5-c]quinolin-4-ium-2-amine Traditional Name: butyl-(4-oxido-[1,2,4]triazino[6,5-c]quinolin-4-ium-2-yl)amine Formula: C14H15N5O MolecularWeight: 269.3018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C=NC3=CC=CC=C32)[N+](=N1)[O-]

Isomeric SMILES

CCCCNC1=NC2=C(C=NC3=CC=CC=C32)[N+](=N1)[O-]

InChI

InChI=1S/C14H15N5O/c1-2-3-8-15-14-17-13-10-6-4-5-7-11(10)16-9-12(13)19(20)18-14/h4-7,9H,2-3,8H2,1H3,(H,15,17,18)