2-(1H-benzimidazol-2-yl)-4-chloranyl-5-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]pyridazin-3-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-4-chloranyl-5-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]pyridazin-3-one Openeye Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]pyridazin-3-one CAS Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[[2-(4-morpholin-4-iumylmethyl)phenyl]methylamino]-3-pyridazinone IUPAC Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methylamino]pyridazin-3-one Traditional Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-[[2-(morpholin-4-ium-4-ylmethyl)benzyl]amino]pyridazin-3-one Formula: C23H24ClN6O2+ MolecularWeight: 451.92866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5N4)Cl

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC3=C(C(=O)N(N=C3)C4=NC5=CC=CC=C5N4)Cl

InChI

InChI=1S/C23H23ClN6O2/c24-21-20(14-26-30(22(21)31)23-27-18-7-3-4-8-19(18)28-23)25-13-16-5-1-2-6-17(16)15-29-9-11-32-12-10-29/h1-8,14,25H,9-13,15H2,(H,27,28)/p+1