N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-(5-bromo-2-fluoro-benzyl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C22H15BrFN3O2 MolecularWeight: 452.275803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=C(C=CC(=C4)Br)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=C(C=CC(=C4)Br)F

InChI

InChI=1S/C22H15BrFN3O2/c23-15-10-11-19(24)14(12-15)13-25-21(28)20-17-8-4-5-9-18(17)22(29)27(26-20)16-6-2-1-3-7-16/h1-12H,13H2,(H,25,28)