N-(3-chloranyl-4-fluoranyl-phenyl)-3-(4-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-(4-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-(4-methoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-keto-3-(4-methoxyphenyl)phthalazine-1-carboxamide Formula: C22H15ClFN3O3 MolecularWeight: 423.824203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H15ClFN3O3/c1-30-15-9-7-14(8-10-15)27-22(29)17-5-3-2-4-16(17)20(26-27)21(28)25-13-6-11-19(24)18(23)12-13/h2-12H,1H3,(H,25,28)