2-[3-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]amino]propyl]guanidine

Systemtic Name: 2-[3-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]amino]propyl]guanidine Openeye Name: 2-[3-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-anilino]propyl]guanidine CAS Name: 2-[3-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitroanilino]propyl]guanidine IUPAC Name: 2-[3-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitroanilino]propyl]guanidine Traditional Name: 2-[3-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-anilino]propyl]guanidine Formula: C15H21N7O3 MolecularWeight: 347.37234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC(=C(C=C2)NCCCN=C(N)N)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC(=C(C=C2)NCCCN=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C15H21N7O3/c1-9-7-13(23)20-21-14(9)10-3-4-11(12(8-10)22(24)25)18-5-2-6-19-15(16)17/h3-4,8-9,18H,2,5-7H2,1H3,(H,20,23)(H4,16,17,19)