(3-ethanoyl-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)methyl butanoate

Systemtic Name: (3-ethanoyl-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)methyl butanoate Openeye Name: (3-acetyl-1-oxido-4-oxo-quinoxalin-4-ium-2-yl)methyl butanoate CAS Name: butanoic acid (3-acetyl-1-oxido-4-oxo-2-quinoxalin-4-iumyl)methyl ester IUPAC Name: (3-acetyl-1-oxido-4-oxoquinoxalin-4-ium-2-yl)methyl butanoate Traditional Name: butyric acid (3-acetyl-4-keto-1-oxido-quinoxalin-4-ium-2-yl)methyl ester Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O5/c1-3-6-14(19)22-9-13-15(10(2)18)17(21)12-8-5-4-7-11(12)16(13)20/h4-5,7-8H,3,6,9H2,1-2H3