3-(2,4-dimethoxyphenyl)-1-[(2-nitrophenyl)methoxy]-4-oxidanidyl-quinoxalin-4-ium-2-one

Systemtic Name: 3-(2,4-dimethoxyphenyl)-1-[(2-nitrophenyl)methoxy]-4-oxidanidyl-quinoxalin-4-ium-2-one Openeye Name: 3-(2,4-dimethoxyphenyl)-1-[(2-nitrophenyl)methoxy]-4-oxido-quinoxalin-4-ium-2-one CAS Name: 3-(2,4-dimethoxyphenyl)-1-[(2-nitrophenyl)methoxy]-4-oxido-2-quinoxalin-4-iumone IUPAC Name: 3-(2,4-dimethoxyphenyl)-1-[(2-nitrophenyl)methoxy]-4-oxidoquinoxalin-4-ium-2-one Traditional Name: 3-(2,4-dimethoxyphenyl)-1-(2-nitrobenzyl)oxy-4-oxido-quinoxalin-4-ium-2-one Formula: C23H19N3O7 MolecularWeight: 449.41286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)OCC4=CC=CC=C4[N+](=O)[O-])[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=[N+](C3=CC=CC=C3N(C2=O)OCC4=CC=CC=C4[N+](=O)[O-])[O-])OC

InChI

InChI=1S/C23H19N3O7/c1-31-16-11-12-17(21(13-16)32-2)22-23(27)25(20-10-6-5-9-19(20)24(22)28)33-14-15-7-3-4-8-18(15)26(29)30/h3-13H,14H2,1-2H3