ethyl 1-(2-methylphenyl)-4-[(4-nitrophenyl)methoxy]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(2-methylphenyl)-4-[(4-nitrophenyl)methoxy]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(4-nitrophenyl)methoxy]-1-(o-tolyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(2-methylphenyl)-4-[(4-nitrophenyl)methoxy]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methylphenyl)-4-[(4-nitrophenyl)methoxy]-6-oxopyridazine-3-carboxylate Traditional Name: 6-keto-4-(4-nitrobenzyl)oxy-1-(o-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OCC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3C

InChI

InChI=1S/C21H19N3O6/c1-3-29-21(26)20-18(30-13-15-8-10-16(11-9-15)24(27)28)12-19(25)23(22-20)17-7-5-4-6-14(17)2/h4-12H,3,13H2,1-2H3