ethyl 5-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoyloxy]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxy-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(4-oxo-3H-phthalazin-1-yl)acetyl]oxy-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[2-(4-keto-3H-phthalazin-1-yl)acetyl]oxy-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C27H20N2O6 MolecularWeight: 468.4575

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)CC3=NNC(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H20N2O6/c1-2-33-27(32)24-20-14-17(12-13-22(20)35-25(24)16-8-4-3-5-9-16)34-23(30)15-21-18-10-6-7-11-19(18)26(31)29-28-21/h3-14H,2,15H2,1H3,(H,29,31)