3-(bromomethyl)-4-oxidanidyl-2-phenylsulfanyl-quinoxalin-1-ium 1-oxide

Systemtic Name: 3-(bromomethyl)-4-oxidanidyl-2-phenylsulfanyl-quinoxalin-1-ium 1-oxide Openeye Name: 3-(bromomethyl)-4-oxido-2-phenylsulfanyl-quinoxalin-1-ium 1-oxide CAS Name: 3-(bromomethyl)-4-oxido-2-(phenylthio)quinoxalin-1-ium 1-oxide IUPAC Name: 3-(bromomethyl)-4-oxido-2-phenylsulfanylquinoxalin-1-ium 1-oxide Traditional Name: 3-(bromomethyl)-4-oxido-2-(phenylthio)quinoxalin-1-ium 1-oxide Formula: C15H11BrN2O2S MolecularWeight: 363.22904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(N(C3=CC=CC=C3[N+]2=O)[O-])CBr

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(N(C3=CC=CC=C3[N+]2=O)[O-])CBr

InChI

InChI=1S/C15H11BrN2O2S/c16-10-14-15(21-11-6-2-1-3-7-11)18(20)13-9-5-4-8-12(13)17(14)19/h1-9H,10H2