[3-(acetyloxymethyl)-6,7-bis(chloranyl)-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl]methyl ethanoate

Systemtic Name: [3-(acetyloxymethyl)-6,7-bis(chloranyl)-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl]methyl ethanoate Openeye Name: [3-(acetoxymethyl)-6,7-dichloro-1-oxido-4-oxo-quinoxalin-4-ium-2-yl]methyl acetate CAS Name: acetic acid [3-(acetyloxymethyl)-6,7-dichloro-1-oxido-4-oxo-2-quinoxalin-4-iumyl]methyl ester IUPAC Name: [3-(acetyloxymethyl)-6,7-dichloro-1-oxido-4-oxoquinoxalin-4-ium-2-yl]methyl acetate Traditional Name: acetic acid [3-(acetoxymethyl)-6,7-dichloro-4-keto-1-oxido-quinoxalin-4-ium-2-yl]methyl ester Formula: C14H12Cl2N2O6 MolecularWeight: 375.16088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])Cl)Cl)COC(=O)C

Isomeric SMILES

CC(=O)OCC1=C([N+](=O)C2=CC(=C(C=C2N1[O-])Cl)Cl)COC(=O)C

InChI

InChI=1S/C14H12Cl2N2O6/c1-7(19)23-5-13-14(6-24-8(2)20)18(22)12-4-10(16)9(15)3-11(12)17(13)21/h3-4H,5-6H2,1-2H3