3-(3-bromophenyl)-4-oxidanidyl-1-(pyridin-2-ylmethoxy)quinoxalin-4-ium-2-one

Systemtic Name: 3-(3-bromophenyl)-4-oxidanidyl-1-(pyridin-2-ylmethoxy)quinoxalin-4-ium-2-one Openeye Name: 3-(3-bromophenyl)-4-oxido-1-(2-pyridylmethoxy)quinoxalin-4-ium-2-one CAS Name: 3-(3-bromophenyl)-4-oxido-1-(2-pyridinylmethoxy)-2-quinoxalin-4-iumone IUPAC Name: 3-(3-bromophenyl)-4-oxido-1-(pyridin-2-ylmethoxy)quinoxalin-4-ium-2-one Traditional Name: 3-(3-bromophenyl)-4-oxido-1-(2-pyridylmethoxy)quinoxalin-4-ium-2-one Formula: C20H14BrN3O3 MolecularWeight: 424.24746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)C(=[N+]2[O-])C3=CC(=CC=C3)Br)OCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)C(=[N+]2[O-])C3=CC(=CC=C3)Br)OCC4=CC=CC=N4

InChI

InChI=1S/C20H14BrN3O3/c21-15-7-5-6-14(12-15)19-20(25)24(27-13-16-8-3-4-11-22-16)18-10-2-1-9-17(18)23(19)26/h1-12H,13H2