2-[[2,6-bis(chloranyl)phenyl]methyl]-5-piperazin-4-ium-1-yl-pyridazin-3-one

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]methyl]-5-piperazin-4-ium-1-yl-pyridazin-3-one Openeye Name: 2-[(2,6-dichlorophenyl)methyl]-5-piperazin-4-ium-1-yl-pyridazin-3-one CAS Name: 2-[(2,6-dichlorophenyl)methyl]-5-(1-piperazin-4-iumyl)-3-pyridazinone IUPAC Name: 2-[(2,6-dichlorophenyl)methyl]-5-piperazin-4-ium-1-ylpyridazin-3-one Traditional Name: 2-(2,6-dichlorobenzyl)-5-piperazin-4-ium-1-yl-pyridazin-3-one Formula: C15H17Cl2N4O+ MolecularWeight: 340.22768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC(=O)N(N=C2)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC(=O)N(N=C2)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C15H16Cl2N4O/c16-13-2-1-3-14(17)12(13)10-21-15(22)8-11(9-19-21)20-6-4-18-5-7-20/h1-3,8-9,18H,4-7,10H2/p+1