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

Systemtic Name: 2-[1-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]piperidin-4-yl]guanidine Openeye Name: 2-[1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]-4-piperidyl]guanidine CAS Name: 2-[1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitrophenyl]-4-piperidinyl]guanidine IUPAC Name: 2-[1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitrophenyl]piperidin-4-yl]guanidine Traditional Name: 2-[1-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]-4-piperidyl]guanidine Formula: C17H23N7O3 MolecularWeight: 373.40962

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCC(CC3)N=C(N)N)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCC(CC3)N=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C17H23N7O3/c1-10-8-15(25)21-22-16(10)11-2-3-13(14(9-11)24(26)27)23-6-4-12(5-7-23)20-17(18)19/h2-3,9-10,12H,4-8H2,1H3,(H,21,25)(H4,18,19,20)