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

Systemtic Name: bis(phenylmethyl) 2-[[6-oxidanylidene-1-(phenylmethyl)pyridazin-4-yl]methylidene]propanedioate Openeye Name: dibenzyl 2-[(1-benzyl-6-oxo-pyridazin-4-yl)methylene]propanedioate CAS Name: 2-[[6-oxo-1-(phenylmethyl)-4-pyridazinyl]methylidene]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[(1-benzyl-6-oxopyridazin-4-yl)methylidene]propanedioate Traditional Name: 2-[(1-benzyl-6-keto-pyridazin-4-yl)methylene]malonic acid dibenzyl ester Formula: C29H24N2O5 MolecularWeight: 480.51126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C=C(C=N2)C=C(C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C=C(C=N2)C=C(C(=O)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H24N2O5/c32-27-17-25(18-30-31(27)19-22-10-4-1-5-11-22)16-26(28(33)35-20-23-12-6-2-7-13-23)29(34)36-21-24-14-8-3-9-15-24/h1-18H,19-21H2