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

Systemtic Name: 3-(2-chlorophenyl)-1-[(4-nitrophenyl)methoxy]-4-oxidanidyl-quinoxalin-4-ium-2-one Openeye Name: 3-(2-chlorophenyl)-1-[(4-nitrophenyl)methoxy]-4-oxido-quinoxalin-4-ium-2-one CAS Name: 3-(2-chlorophenyl)-1-[(4-nitrophenyl)methoxy]-4-oxido-2-quinoxalin-4-iumone IUPAC Name: 3-(2-chlorophenyl)-1-[(4-nitrophenyl)methoxy]-4-oxidoquinoxalin-4-ium-2-one Traditional Name: 3-(2-chlorophenyl)-1-(4-nitrobenzyl)oxy-4-oxido-quinoxalin-4-ium-2-one Formula: C21H14ClN3O5 MolecularWeight: 423.80596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14ClN3O5/c22-17-6-2-1-5-16(17)20-21(26)24(19-8-4-3-7-18(19)23(20)27)30-13-14-9-11-15(12-10-14)25(28)29/h1-12H,13H2