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

Systemtic Name: ethyl 1-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperazine-2-carboxylate Openeye Name: ethyl 1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperazine-2-carboxylate CAS Name: 1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitrophenyl]-2-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-5-yl)-2-nitrophenyl]piperazine-2-carboxylate Traditional Name: 1-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-5-yl)-2-nitro-phenyl]piperazine-2-carboxylic acid ethyl ester Formula: C18H23N5O5 MolecularWeight: 389.40572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CNCCN1C2=C(C=C(C=C2)C3C(C=NNC3=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CNCCN1C2=C(C=C(C=C2)C3C(C=NNC3=O)C)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O5/c1-3-28-18(25)15-10-19-6-7-22(15)13-5-4-12(8-14(13)23(26)27)16-11(2)9-20-21-17(16)24/h4-5,8-9,11,15-16,19H,3,6-7,10H2,1-2H3,(H,21,24)