4-azanyl-N'-(5-bromanylpyridin-1-ium-3-yl)carbonyl-quinoline-3-carbohydrazide

Systemtic Name: 4-azanyl-N'-(5-bromanylpyridin-1-ium-3-yl)carbonyl-quinoline-3-carbohydrazide Openeye Name: 4-amino-N'-(5-bromopyridin-1-ium-3-carbonyl)quinoline-3-carbohydrazide CAS Name: 4-amino-N'-[(5-bromo-3-pyridin-1-iumyl)-oxomethyl]-3-quinolinecarbohydrazide IUPAC Name: 4-amino-N'-(5-bromopyridin-1-ium-3-carbonyl)quinoline-3-carbohydrazide Traditional Name: 4-amino-N'-(5-bromopyridin-1-ium-3-carbonyl)quinoline-3-carbohydrazide Formula: C16H13BrN5O2+ MolecularWeight: 387.21072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C(=O)NNC(=O)C3=CC(=C[NH+]=C3)Br)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C(=O)NNC(=O)C3=CC(=C[NH+]=C3)Br)N

InChI

InChI=1S/C16H12BrN5O2/c17-10-5-9(6-19-7-10)15(23)21-22-16(24)12-8-20-13-4-2-1-3-11(13)14(12)18/h1-8H,(H2,18,20)(H,21,23)(H,22,24)/p+1