7-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-(4-ethoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 7-[(4-bromanyl-2-fluoranyl-phenyl)amino]-6-(4-ethoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 7-(4-bromo-2-fluoro-anilino)-6-(4-ethoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 7-(4-bromo-2-fluoroanilino)-6-(4-ethoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 7-(4-bromo-2-fluoroanilino)-6-(4-ethoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 7-(4-bromo-2-fluoro-anilino)-6-p-phenetyl-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C21H17BrFN3O2 MolecularWeight: 442.280983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(C3=C(C2=O)C=CC=N3)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(C3=C(C2=O)C=CC=N3)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C21H17BrFN3O2/c1-2-28-15-8-6-14(7-9-15)26-20(19-16(21(26)27)4-3-11-24-19)25-18-10-5-13(22)12-17(18)23/h3-12,20,25H,2H2,1H3