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

Systemtic Name: [1-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]piperidin-4-yl] hydrogen carbonate Openeye Name: [1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]-4-piperidyl] hydrogen carbonate CAS Name: carbonic acid [1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitrophenyl]-4-piperidinyl] ester IUPAC Name: [1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2-nitrophenyl]piperidin-4-yl] hydrogen carbonate Traditional Name: carbonic acid [1-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)-2-nitro-phenyl]-4-piperidyl] ester Formula: C17H20N4O6 MolecularWeight: 376.3639

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O6/c1-10-8-15(22)18-19-16(10)11-2-3-13(14(9-11)21(25)26)20-6-4-12(5-7-20)27-17(23)24/h2-3,9-10,12H,4-8H2,1H3,(H,18,22)(H,23,24)