[3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyloxymethyl]phenyl]methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: [3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyloxymethyl]phenyl]methyl 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [3-[(4-oxo-3H-phthalazine-1-carbonyl)oxymethyl]phenyl]methyl 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methoxy]methyl]phenyl]methyl ester IUPAC Name: [3-[(4-oxo-3H-phthalazine-1-carbonyl)oxymethyl]phenyl]methyl 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [3-[(4-keto-3H-phthalazine-1-carbonyl)oxymethyl]benzyl] ester Formula: C26H18N4O6 MolecularWeight: 482.44432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC3=CC(=CC=C3)COC(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC3=CC(=CC=C3)COC(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C26H18N4O6/c31-23-19-10-3-1-8-17(19)21(27-29-23)25(33)35-13-15-6-5-7-16(12-15)14-36-26(34)22-18-9-2-4-11-20(18)24(32)30-28-22/h1-12H,13-14H2,(H,29,31)(H,30,32)