methyl 7-methoxy-3-[(4-methoxyphenyl)carbonyloxymethyl]-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 7-methoxy-3-[(4-methoxyphenyl)carbonyloxymethyl]-1-oxidanidyl-quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 7-methoxy-3-[(4-methoxybenzoyl)oxymethyl]-1-oxido-quinoxalin-1-ium-2-carboxylate CAS Name: 7-methoxy-3-[[(4-methoxyphenyl)-oxomethoxy]methyl]-1-oxido-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 7-methoxy-3-[(4-methoxybenzoyl)oxymethyl]-1-oxidoquinoxalin-1-ium-2-carboxylate Traditional Name: 7-methoxy-1-oxido-3-(p-anisoyloxymethyl)quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C20H18N2O7 MolecularWeight: 398.36612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCC2=NC3=C(C=C(C=C3)OC)[N+](=C2C(=O)OC)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OCC2=NC3=C(C=C(C=C3)OC)[N+](=C2C(=O)OC)[O-]

InChI

InChI=1S/C20H18N2O7/c1-26-13-6-4-12(5-7-13)19(23)29-11-16-18(20(24)28-3)22(25)17-10-14(27-2)8-9-15(17)21-16/h4-10H,11H2,1-3H3