7-azanyl-6-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-3-(hydroxymethyl)-1H-quinoxalin-2-one

Systemtic Name: 7-azanyl-6-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-3-(hydroxymethyl)-1H-quinoxalin-2-one Openeye Name: 7-amino-6-[(4-bromo-2-fluoro-phenyl)methylamino]-3-(hydroxymethyl)-1H-quinoxalin-2-one CAS Name: 7-amino-6-[(4-bromo-2-fluorophenyl)methylamino]-3-(hydroxymethyl)-1H-quinoxalin-2-one IUPAC Name: 7-amino-6-[(4-bromo-2-fluorophenyl)methylamino]-3-(hydroxymethyl)-1H-quinoxalin-2-one Traditional Name: 7-amino-6-[(4-bromo-2-fluoro-benzyl)amino]-3-methylol-1H-quinoxalin-2-one Formula: C16H14BrFN4O2 MolecularWeight: 393.210363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)F)CNC2=C(C=C3C(=C2)N=C(C(=O)N3)CO)N

Isomeric SMILES

C1=CC(=C(C=C1Br)F)CNC2=C(C=C3C(=C2)N=C(C(=O)N3)CO)N

InChI

InChI=1S/C16H14BrFN4O2/c17-9-2-1-8(10(18)3-9)6-20-12-5-14-13(4-11(12)19)22-16(24)15(7-23)21-14/h1-5,20,23H,6-7,19H2,(H,22,24)