3-[(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)amino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)amino]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)amino]propyl]-methyl-ammonium CAS Name: 3-[(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)amino]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[(5-chloro-6-oxo-1-phenylpyridazin-4-yl)amino]propyl]-methylazanium Traditional Name: benzyl-[3-[(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)amino]propyl]-methyl-ammonium Formula: C21H24ClN4O+ MolecularWeight: 383.89446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC1=C(C(=O)N(N=C1)C2=CC=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC1=C(C(=O)N(N=C1)C2=CC=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H23ClN4O/c1-25(16-17-9-4-2-5-10-17)14-8-13-23-19-15-24-26(21(27)20(19)22)18-11-6-3-7-12-18/h2-7,9-12,15,23H,8,13-14,16H2,1H3/p+1