3-azanyl-2-(5-bromanyl-2-fluoranyl-phenyl)isoquinolin-1-one

Systemtic Name: 3-azanyl-2-(5-bromanyl-2-fluoranyl-phenyl)isoquinolin-1-one Openeye Name: 3-amino-2-(5-bromo-2-fluoro-phenyl)isoquinolin-1-one CAS Name: 3-amino-2-(5-bromo-2-fluorophenyl)-1-isoquinolinone IUPAC Name: 3-amino-2-(5-bromo-2-fluorophenyl)isoquinolin-1-one Traditional Name: 3-amino-2-(5-bromo-2-fluoro-phenyl)isocarbostyril Formula: C15H10BrFN2O MolecularWeight: 333.155103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N(C2=O)C3=C(C=CC(=C3)Br)F)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N(C2=O)C3=C(C=CC(=C3)Br)F)N

InChI

InChI=1S/C15H10BrFN2O/c16-10-5-6-12(17)13(8-10)19-14(18)7-9-3-1-2-4-11(9)15(19)20/h1-8H,18H2