(3-ethoxycarbonyl-2-phenyl-1-benzofuran-5-yl) 2,5,6-trimethyl-3-oxidanylidene-pyridazine-4-carboxylate

Systemtic Name: (3-ethoxycarbonyl-2-phenyl-1-benzofuran-5-yl) 2,5,6-trimethyl-3-oxidanylidene-pyridazine-4-carboxylate Openeye Name: (3-ethoxycarbonyl-2-phenyl-benzofuran-5-yl) 2,5,6-trimethyl-3-oxo-pyridazine-4-carboxylate CAS Name: 2,5,6-trimethyl-3-oxo-4-pyridazinecarboxylic acid (3-ethoxycarbonyl-2-phenyl-5-benzofuranyl) ester IUPAC Name: (3-ethoxycarbonyl-2-phenyl-1-benzofuran-5-yl) 2,5,6-trimethyl-3-oxopyridazine-4-carboxylate Traditional Name: 3-keto-2,5,6-trimethyl-pyridazine-4-carboxylic acid (3-carbethoxy-2-phenyl-benzofuran-5-yl) ester Formula: C25H22N2O6 MolecularWeight: 446.45198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)C3=C(C(=NN(C3=O)C)C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)C3=C(C(=NN(C3=O)C)C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O6/c1-5-31-24(29)21-18-13-17(11-12-19(18)33-22(21)16-9-7-6-8-10-16)32-25(30)20-14(2)15(3)26-27(4)23(20)28/h6-13H,5H2,1-4H3