2-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4H-isoquinoline-1,3-dione

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-4H-isoquinoline-1,3-dione Openeye Name: 2-[(4-bromo-2-fluoro-phenyl)methyl]-4H-isoquinoline-1,3-dione CAS Name: 2-[(4-bromo-2-fluorophenyl)methyl]-4H-isoquinoline-1,3-dione IUPAC Name: 2-[(4-bromo-2-fluorophenyl)methyl]-4H-isoquinoline-1,3-dione Traditional Name: 2-(4-bromo-2-fluoro-benzyl)-4H-isoquinoline-1,3-quinone Formula: C16H11BrFNO2 MolecularWeight: 348.166443

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H11BrFNO2/c17-12-6-5-11(14(18)8-12)9-19-15(20)7-10-3-1-2-4-13(10)16(19)21/h1-6,8H,7,9H2