(6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 6-oxidanylidene-1-phenyl-4,5-dihydropyridazine-3-carboxylate

Systemtic Name: (6-bromanyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 6-oxidanylidene-1-phenyl-4,5-dihydropyridazine-3-carboxylate Openeye Name: (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxylate CAS Name: 6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxylic acid (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl 6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxylate Traditional Name: 6-keto-1-phenyl-4,5-dihydropyridazine-3-carboxylic acid (6-bromo-2-phenyl-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C26H21BrN2O5 MolecularWeight: 521.35934

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(N=C1C(=O)OCC2=C3C(=CC(=C2)Br)COC(O3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(N=C1C(=O)OCC2=C3C(=CC(=C2)Br)COC(O3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H21BrN2O5/c27-20-13-18(24-19(14-20)16-33-26(34-24)17-7-3-1-4-8-17)15-32-25(31)22-11-12-23(30)29(28-22)21-9-5-2-6-10-21/h1-10,13-14,26H,11-12,15-16H2