ethyl 7-ethoxy-1-oxidanidyl-3-[(3,4,5-trimethoxyphenyl)carbonyloxymethyl]quinoxalin-1-ium-2-carboxylate

Systemtic Name: ethyl 7-ethoxy-1-oxidanidyl-3-[(3,4,5-trimethoxyphenyl)carbonyloxymethyl]quinoxalin-1-ium-2-carboxylate Openeye Name: ethyl 7-ethoxy-1-oxido-3-[(3,4,5-trimethoxybenzoyl)oxymethyl]quinoxalin-1-ium-2-carboxylate CAS Name: 7-ethoxy-1-oxido-3-[[oxo-(3,4,5-trimethoxyphenyl)methoxy]methyl]-2-quinoxalin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 7-ethoxy-1-oxido-3-[(3,4,5-trimethoxybenzoyl)oxymethyl]quinoxalin-1-ium-2-carboxylate Traditional Name: 7-ethoxy-1-oxido-3-[(3,4,5-trimethoxybenzoyl)oxymethyl]quinoxalin-1-ium-2-carboxylic acid ethyl ester Formula: C24H26N2O9 MolecularWeight: 486.47124

Click to see the large picture

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)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)OC

InChI

InChI=1S/C24H26N2O9/c1-6-33-15-8-9-16-18(12-15)26(29)21(24(28)34-7-2)17(25-16)13-35-23(27)14-10-19(30-3)22(32-5)20(11-14)31-4/h8-12H,6-7,13H2,1-5H3