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

Systemtic Name: (3-ethanoyl-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)methyl benzoate Openeye Name: (3-acetyl-1-oxido-4-oxo-quinoxalin-4-ium-2-yl)methyl benzoate CAS Name: benzoic 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 benzoate Traditional Name: benzoic acid (3-acetyl-4-keto-1-oxido-quinoxalin-4-ium-2-yl)methyl ester Formula: C18H14N2O5 MolecularWeight: 338.31416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])COC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=C(N(C2=CC=CC=C2[N+]1=O)[O-])COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H14N2O5/c1-12(21)17-16(11-25-18(22)13-7-3-2-4-8-13)19(23)14-9-5-6-10-15(14)20(17)24/h2-10H,11H2,1H3