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

Systemtic Name: 1-[(2-nitrophenyl)methoxy]-4-oxidanidyl-3-phenyl-quinoxalin-4-ium-2-one Openeye Name: 1-[(2-nitrophenyl)methoxy]-4-oxido-3-phenyl-quinoxalin-4-ium-2-one CAS Name: 1-[(2-nitrophenyl)methoxy]-4-oxido-3-phenyl-2-quinoxalin-4-iumone IUPAC Name: 1-[(2-nitrophenyl)methoxy]-4-oxido-3-phenylquinoxalin-4-ium-2-one Traditional Name: 1-(2-nitrobenzyl)oxy-4-oxido-3-phenyl-quinoxalin-4-ium-2-one Formula: C21H15N3O5 MolecularWeight: 389.3609

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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=CC=C4[N+](=O)[O-])[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H15N3O5/c25-21-20(15-8-2-1-3-9-15)22(26)18-12-6-7-13-19(18)23(21)29-14-16-10-4-5-11-17(16)24(27)28/h1-13H,14H2