bis(phenylmethyl) 2-[(6-oxidanylidene-1H-pyridazin-4-yl)methylidene]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[(6-oxidanylidene-1H-pyridazin-4-yl)methylidene]propanedioate Openeye Name: dibenzyl 2-[(6-oxo-1H-pyridazin-4-yl)methylene]propanedioate CAS Name: 2-[(6-oxo-1H-pyridazin-4-yl)methylidene]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[(6-oxo-1H-pyridazin-4-yl)methylidene]propanedioate Traditional Name: 2-[(6-keto-1H-pyridazin-4-yl)methylene]malonic acid dibenzyl ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=CC2=CC(=O)NN=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(=CC2=CC(=O)NN=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H18N2O5/c25-20-12-18(13-23-24-20)11-19(21(26)28-14-16-7-3-1-4-8-16)22(27)29-15-17-9-5-2-6-10-17/h1-13H,14-15H2,(H,24,25)