ethyl 6-(4-cyanophenyl)-3-oxidanylidene-2-(phenylmethyl)pyridazine-4-carboxylate

Systemtic Name: ethyl 6-(4-cyanophenyl)-3-oxidanylidene-2-(phenylmethyl)pyridazine-4-carboxylate Openeye Name: ethyl 2-benzyl-6-(4-cyanophenyl)-3-oxo-pyridazine-4-carboxylate CAS Name: 6-(4-cyanophenyl)-3-oxo-2-(phenylmethyl)-4-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-benzyl-6-(4-cyanophenyl)-3-oxopyridazine-4-carboxylate Traditional Name: 2-benzyl-6-(4-cyanophenyl)-3-keto-pyridazine-4-carboxylic acid ethyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN(C1=O)CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=NN(C1=O)CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H17N3O3/c1-2-27-21(26)18-12-19(17-10-8-15(13-22)9-11-17)23-24(20(18)25)14-16-6-4-3-5-7-16/h3-12H,2,14H2,1H3