ethyl 3-[(3,4-dimethoxyphenyl)carbonyloxymethyl]-7-ethoxy-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate

Systemtic Name: ethyl 3-[(3,4-dimethoxyphenyl)carbonyloxymethyl]-7-ethoxy-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate Openeye Name: ethyl 3-[(3,4-dimethoxybenzoyl)oxymethyl]-7-ethoxy-1-oxido-quinoxalin-1-ium-2-carboxylate CAS Name: 3-[[(3,4-dimethoxyphenyl)-oxomethoxy]methyl]-7-ethoxy-1-oxido-2-quinoxalin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3,4-dimethoxybenzoyl)oxymethyl]-7-ethoxy-1-oxidoquinoxalin-1-ium-2-carboxylate Traditional Name: 7-ethoxy-1-oxido-3-(veratroyloxymethyl)quinoxalin-1-ium-2-carboxylic acid ethyl ester Formula: C23H24N2O8 MolecularWeight: 456.44526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O8/c1-5-31-15-8-9-16-18(12-15)25(28)21(23(27)32-6-2)17(24-16)13-33-22(26)14-7-10-19(29-3)20(11-14)30-4/h7-12H,5-6,13H2,1-4H3