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

Systemtic Name: ethyl 1-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperidine-4-carboxylate CAS Name: 1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitrophenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitrophenyl]piperidine-4-carboxylate Traditional Name: 1-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]isonipecotic acid ethyl ester Formula: C19H24N4O5 MolecularWeight: 388.41766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C3C(C=NNC3=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C3C(C=NNC3=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O5/c1-3-28-19(25)13-6-8-22(9-7-13)15-5-4-14(10-16(15)23(26)27)17-12(2)11-20-21-18(17)24/h4-5,10-13,17H,3,6-9H2,1-2H3,(H,21,24)