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

Systemtic Name: 2-[2-[[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]amino]ethyl]guanidine Openeye Name: 2-[2-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-anilino]ethyl]guanidine CAS Name: 2-[2-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitroanilino]ethyl]guanidine IUPAC Name: 2-[2-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitroanilino]ethyl]guanidine Traditional Name: 2-[2-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-anilino]ethyl]guanidine Formula: C14H19N7O3 MolecularWeight: 333.34576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N7O3/c1-8-6-12(22)19-20-13(8)9-2-3-10(11(7-9)21(23)24)17-4-5-18-14(15)16/h2-3,7-8,17H,4-6H2,1H3,(H,19,22)(H4,15,16,18)