ethyl 7-methoxy-1-oxidanidyl-3-(pyridin-3-ylcarbonyloxymethyl)quinoxalin-1-ium-2-carboxylate

Systemtic Name: ethyl 7-methoxy-1-oxidanidyl-3-(pyridin-3-ylcarbonyloxymethyl)quinoxalin-1-ium-2-carboxylate Openeye Name: ethyl 7-methoxy-1-oxido-3-(pyridine-3-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate CAS Name: 7-methoxy-1-oxido-3-[[oxo(3-pyridinyl)methoxy]methyl]-2-quinoxalin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 7-methoxy-1-oxido-3-(pyridine-3-carbonyloxymethyl)quinoxalin-1-ium-2-carboxylate Traditional Name: 7-methoxy-3-(nicotinoyloxymethyl)-1-oxido-quinoxalin-1-ium-2-carboxylic acid ethyl ester Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=[N+](C2=C(C=CC(=C2)OC)N=C1COC(=O)C3=CN=CC=C3)[O-]

Isomeric SMILES

CCOC(=O)C1=[N+](C2=C(C=CC(=C2)OC)N=C1COC(=O)C3=CN=CC=C3)[O-]

InChI

InChI=1S/C19H17N3O6/c1-3-27-19(24)17-15(11-28-18(23)12-5-4-8-20-10-12)21-14-7-6-13(26-2)9-16(14)22(17)25/h4-10H,3,11H2,1-2H3