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

Systemtic Name: ethyl 1-oxidanidyl-3-(oxolan-2-ylcarbonyloxymethyl)quinoxalin-1-ium-2-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O6/c1-2-23-17(21)15-12(10-25-16(20)14-8-5-9-24-14)18-11-6-3-4-7-13(11)19(15)22/h3-4,6-7,14H,2,5,8-10H2,1H3