5-[(4-bromanyl-5-tert-butyl-2-methyl-phenyl)amino]-9-fluoranyl-2H-benzo[h][2,6]naphthyridin-1-one

Systemtic Name: 5-[(4-bromanyl-5-tert-butyl-2-methyl-phenyl)amino]-9-fluoranyl-2H-benzo[h][2,6]naphthyridin-1-one Openeye Name: 5-(4-bromo-5-tert-butyl-2-methyl-anilino)-9-fluoro-2H-benzo[h][2,6]naphthyridin-1-one CAS Name: 5-(4-bromo-5-tert-butyl-2-methylanilino)-9-fluoro-2H-benzo[h][2,6]naphthyridin-1-one IUPAC Name: 5-(4-bromo-5-tert-butyl-2-methylanilino)-9-fluoro-2H-benzo[h][2,6]naphthyridin-1-one Traditional Name: 5-(4-bromo-5-tert-butyl-2-methyl-anilino)-9-fluoro-2H-benzo[h][2,6]naphthyridin-1-one Formula: C23H21BrFN3O MolecularWeight: 454.334743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)Br)C(C)(C)C)NC2=NC3=C(C=C(C=C3)F)C4=C2C=CNC4=O

Isomeric SMILES

CC1=C(C=C(C(=C1)Br)C(C)(C)C)NC2=NC3=C(C=C(C=C3)F)C4=C2C=CNC4=O

InChI

InChI=1S/C23H21BrFN3O/c1-12-9-17(24)16(23(2,3)4)11-19(12)28-21-14-7-8-26-22(29)20(14)15-10-13(25)5-6-18(15)27-21/h5-11H,1-4H3,(H,26,29)(H,27,28)