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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-(4-ethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-(4-ethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-(4-ethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-keto-3-p-phenetyl-phthalazine-1-carboxamide Formula: C23H17ClFN3O3 MolecularWeight: 437.850783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C23H17ClFN3O3/c1-2-31-16-10-8-15(9-11-16)28-23(30)18-6-4-3-5-17(18)21(27-28)22(29)26-14-7-12-20(25)19(24)13-14/h3-13H,2H2,1H3,(H,26,29)