ethyl 2-[3-(4-bromophenyl)-4-oxidanidyl-2-oxidanylidene-quinoxalin-4-ium-1-yl]oxyethanoate

Systemtic Name: ethyl 2-[3-(4-bromophenyl)-4-oxidanidyl-2-oxidanylidene-quinoxalin-4-ium-1-yl]oxyethanoate Openeye Name: ethyl 2-[3-(4-bromophenyl)-4-oxido-2-oxo-quinoxalin-4-ium-1-yl]oxyacetate CAS Name: 2-[[3-(4-bromophenyl)-4-oxido-2-oxo-1-quinoxalin-4-iumyl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-bromophenyl)-4-oxido-2-oxoquinoxalin-4-ium-1-yl]oxyacetate Traditional Name: 2-[3-(4-bromophenyl)-2-keto-4-oxido-quinoxalin-4-ium-1-yl]oxyacetic acid ethyl ester Formula: C18H15BrN2O5 MolecularWeight: 419.2261

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CON1C2=CC=CC=C2[N+](=C(C1=O)C3=CC=C(C=C3)Br)[O-]

Isomeric SMILES

CCOC(=O)CON1C2=CC=CC=C2[N+](=C(C1=O)C3=CC=C(C=C3)Br)[O-]

InChI

InChI=1S/C18H15BrN2O5/c1-2-25-16(22)11-26-21-15-6-4-3-5-14(15)20(24)17(18(21)23)12-7-9-13(19)10-8-12/h3-10H,2,11H2,1H3