methyl 1-oxidanidyl-3-(oxolan-2-ylcarbonyloxymethyl)quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 1-oxidanidyl-3-(oxolan-2-ylcarbonyloxymethyl)quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 1-oxido-3-(tetrahydrofuran-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate CAS Name: 1-oxido-3-[[oxo(2-oxolanyl)methoxy]methyl]-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-oxido-3-(oxolane-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate Traditional Name: 1-oxido-3-(tetrahydrofuran-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=[N+](C2=CC=CC=C2N=C1COC(=O)C3CCCO3)[O-]

Isomeric SMILES

COC(=O)C1=[N+](C2=CC=CC=C2N=C1COC(=O)C3CCCO3)[O-]

InChI

InChI=1S/C16H16N2O6/c1-22-16(20)14-11(9-24-15(19)13-7-4-8-23-13)17-10-5-2-3-6-12(10)18(14)21/h2-3,5-6,13H,4,7-9H2,1H3