ethyl 3-(2,2-dimethylpropanoyloxymethyl)-7-ethoxy-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate

Systemtic Name: ethyl 3-(2,2-dimethylpropanoyloxymethyl)-7-ethoxy-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate Openeye Name: ethyl 3-(2,2-dimethylpropanoyloxymethyl)-7-ethoxy-1-oxido-quinoxalin-1-ium-2-carboxylate CAS Name: 3-[(2,2-dimethyl-1-oxopropoxy)methyl]-7-ethoxy-1-oxido-2-quinoxalin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2,2-dimethylpropanoyloxymethyl)-7-ethoxy-1-oxidoquinoxalin-1-ium-2-carboxylate Traditional Name: 7-ethoxy-1-oxido-3-(pivaloyloxymethyl)quinoxalin-1-ium-2-carboxylic acid ethyl ester Formula: C19H24N2O6 MolecularWeight: 376.40366

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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)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O6/c1-6-25-12-8-9-13-15(10-12)21(24)16(17(22)26-7-2)14(20-13)11-27-18(23)19(3,4)5/h8-10H,6-7,11H2,1-5H3