3-[5-bromanyl-2-[(phenylmethyl)amino]phenyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[5-bromanyl-2-[(phenylmethyl)amino]phenyl]-1H-quinoxalin-2-one Openeye Name: 3-[2-(benzylamino)-5-bromo-phenyl]-1H-quinoxalin-2-one CAS Name: 3-[5-bromo-2-[(phenylmethyl)amino]phenyl]-1H-quinoxalin-2-one IUPAC Name: 3-[2-(benzylamino)-5-bromophenyl]-1H-quinoxalin-2-one Traditional Name: 3-[2-(benzylamino)-5-bromo-phenyl]-1H-quinoxalin-2-one Formula: C21H16BrN3O MolecularWeight: 406.27524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H16BrN3O/c22-15-10-11-17(23-13-14-6-2-1-3-7-14)16(12-15)20-21(26)25-19-9-5-4-8-18(19)24-20/h1-12,23H,13H2,(H,25,26)