methyl 3-(acetyloxymethyl)-7-methoxy-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 3-(acetyloxymethyl)-7-methoxy-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 3-(acetoxymethyl)-7-methoxy-1-oxido-quinoxalin-1-ium-2-carboxylate CAS Name: 3-(acetyloxymethyl)-7-methoxy-1-oxido-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 3-(acetyloxymethyl)-7-methoxy-1-oxidoquinoxalin-1-ium-2-carboxylate Traditional Name: 3-(acetoxymethyl)-7-methoxy-1-oxido-quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C14H14N2O6 MolecularWeight: 306.27076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=NC2=C(C=C(C=C2)OC)[N+](=C1C(=O)OC)[O-]

Isomeric SMILES

CC(=O)OCC1=NC2=C(C=C(C=C2)OC)[N+](=C1C(=O)OC)[O-]

InChI

InChI=1S/C14H14N2O6/c1-8(17)22-7-11-13(14(18)21-3)16(19)12-6-9(20-2)4-5-10(12)15-11/h4-6H,7H2,1-3H3