[4-[bis(fluoranyl)methoxy]-3-chloranyl-5-methoxy-phenyl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [4-[bis(fluoranyl)methoxy]-3-chloranyl-5-methoxy-phenyl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [3-chloro-4-(difluoromethoxy)-5-methoxy-phenyl]methyl 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid [3-chloro-4-(difluoromethoxy)-5-methoxyphenyl]methyl ester IUPAC Name: [3-chloro-4-(difluoromethoxy)-5-methoxyphenyl]methyl 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid [3-chloro-4-(difluoromethoxy)-5-methoxy-benzyl] ester Formula: C19H15ClF2N2O5 MolecularWeight: 424.782606

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=C(C(=C3)Cl)OC(F)F)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=C(C(=C3)Cl)OC(F)F)OC

InChI

InChI=1S/C19H15ClF2N2O5/c1-24-17(25)12-6-4-3-5-11(12)15(23-24)18(26)28-9-10-7-13(20)16(29-19(21)22)14(8-10)27-2/h3-8,19H,9H2,1-2H3