1-[(2-bromophenyl)methoxy]-4-oxidanidyl-3-(4-propoxyphenyl)quinoxalin-4-ium-2-one

Systemtic Name: 1-[(2-bromophenyl)methoxy]-4-oxidanidyl-3-(4-propoxyphenyl)quinoxalin-4-ium-2-one Openeye Name: 1-[(2-bromophenyl)methoxy]-4-oxido-3-(4-propoxyphenyl)quinoxalin-4-ium-2-one CAS Name: 1-[(2-bromophenyl)methoxy]-4-oxido-3-(4-propoxyphenyl)-2-quinoxalin-4-iumone IUPAC Name: 1-[(2-bromophenyl)methoxy]-4-oxido-3-(4-propoxyphenyl)quinoxalin-4-ium-2-one Traditional Name: 1-(2-bromobenzyl)oxy-4-oxido-3-(4-propoxyphenyl)quinoxalin-4-ium-2-one Formula: C24H21BrN2O4 MolecularWeight: 481.33854

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)OCC4=CC=CC=C4Br)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)OCC4=CC=CC=C4Br)[O-]

InChI

InChI=1S/C24H21BrN2O4/c1-2-15-30-19-13-11-17(12-14-19)23-24(28)27(22-10-6-5-9-21(22)26(23)29)31-16-18-7-3-4-8-20(18)25/h3-14H,2,15-16H2,1H3