methyl 7-ethoxy-1-oxidanidyl-3-(thiophen-2-ylcarbonyloxymethyl)quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 7-ethoxy-1-oxidanidyl-3-(thiophen-2-ylcarbonyloxymethyl)quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 7-ethoxy-1-oxido-3-(thiophene-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate CAS Name: 7-ethoxy-1-oxido-3-[[oxo(thiophen-2-yl)methoxy]methyl]-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 7-ethoxy-1-oxido-3-(thiophene-2-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate Traditional Name: 7-ethoxy-1-oxido-3-(2-thenoyloxymethyl)quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C18H16N2O6S MolecularWeight: 388.39444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C(=[N+]2[O-])C(=O)OC)COC(=O)C3=CC=CS3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C(=[N+]2[O-])C(=O)OC)COC(=O)C3=CC=CS3

InChI

InChI=1S/C18H16N2O6S/c1-3-25-11-6-7-12-14(9-11)20(23)16(18(22)24-2)13(19-12)10-26-17(21)15-5-4-8-27-15/h4-9H,3,10H2,1-2H3