diethyl 5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyloxybenzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyloxybenzene-1,3-dicarboxylate Openeye Name: diethyl 5-(3-methyl-4-oxo-phthalazine-1-carbonyl)oxybenzene-1,3-dicarboxylate CAS Name: 5-[(3-methyl-4-oxo-1-phthalazinyl)-oxomethoxy]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(3-methyl-4-oxophthalazine-1-carbonyl)oxybenzene-1,3-dicarboxylate Traditional Name: 5-(4-keto-3-methyl-phthalazine-1-carbonyl)oxybenzene-1,3-dicarboxylic acid diethyl ester Formula: C22H20N2O7 MolecularWeight: 424.4034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C(=O)OCC

InChI

InChI=1S/C22H20N2O7/c1-4-29-20(26)13-10-14(21(27)30-5-2)12-15(11-13)31-22(28)18-16-8-6-7-9-17(16)19(25)24(3)23-18/h6-12H,4-5H2,1-3H3