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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)C(=[N+]2[O-])C3=CC(=CC=C3)[N+](=O)[O-])OCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)C(=[N+]2[O-])C3=CC(=CC=C3)[N+](=O)[O-])OCC4=CC=C(C=C4)Cl

InChI

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