(4-cyanophenyl)methyl 6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 6-methyl-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxylate Openeye Name: (4-cyanophenyl)methyl 6-methyl-1-(2-nitrophenyl)-4-oxo-pyridazine-3-carboxylate CAS Name: 6-methyl-1-(2-nitrophenyl)-4-oxo-3-pyridazinecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 6-methyl-1-(2-nitrophenyl)-4-oxopyridazine-3-carboxylate Traditional Name: 4-keto-6-methyl-1-(2-nitrophenyl)pyridazine-3-carboxylic acid (4-cyanobenzyl) ester Formula: C20H14N4O5 MolecularWeight: 390.34896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H14N4O5/c1-13-10-18(25)19(20(26)29-12-15-8-6-14(11-21)7-9-15)22-23(13)16-4-2-3-5-17(16)24(27)28/h2-10H,12H2,1H3