(5-ethanoyl-2-ethoxy-phenyl)methyl 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 6-oxidanylidene-4,5-dihydro-1H-pyridazine-3-carboxylate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate CAS Name: 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylate Traditional Name: 6-keto-4,5-dihydro-1H-pyridazine-3-carboxylic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=NNC(=O)CC2

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=NNC(=O)CC2

InChI

InChI=1S/C16H18N2O5/c1-3-22-14-6-4-11(10(2)19)8-12(14)9-23-16(21)13-5-7-15(20)18-17-13/h4,6,8H,3,5,7,9H2,1-2H3,(H,18,20)