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

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

Systemtic Name:methyl 1-oxidanidyl-3-[(3,4,5-trimethoxyphenyl)carbonyloxymethyl]quinoxalin-1-ium-2-carboxylate
Openeye Name:methyl 1-oxido-3-[(3,4,5-trimethoxybenzoyl)oxymethyl]quinoxalin-1-ium-2-carboxylate
CAS Name:1-oxido-3-[[oxo-(3,4,5-trimethoxyphenyl)methoxy]methyl]-2-quinoxalin-1-iumcarboxylic acid methyl ester
IUPAC Name:methyl 1-oxido-3-[(3,4,5-trimethoxybenzoyl)oxymethyl]quinoxalin-1-ium-2-carboxylate
Traditional Name:1-oxido-3-[(3,4,5-trimethoxybenzoyl)oxymethyl]quinoxalin-1-ium-2-carboxylic acid methyl ester
Formula: C21H20N2O8
MolecularWeight: 428.3921
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC2=NC3=CC=CC=C3[N+](=C2C(=O)OC)[O-]


Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC2=NC3=CC=CC=C3[N+](=C2C(=O)OC)[O-]


InChI

InChI=1S/C21H20N2O8/c1-27-16-9-12(10-17(28-2)19(16)29-3)20(24)31-11-14-18(21(25)30-4)23(26)15-8-6-5-7-13(15)22-14/h5-10H,11H2,1-4H3


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