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

Systemtic Name: 3-(3-chlorophenyl)-1-[(3-fluorophenyl)methoxy]-4-oxidanidyl-quinoxalin-4-ium-2-one Openeye Name: 3-(3-chlorophenyl)-1-[(3-fluorophenyl)methoxy]-4-oxido-quinoxalin-4-ium-2-one CAS Name: 3-(3-chlorophenyl)-1-[(3-fluorophenyl)methoxy]-4-oxido-2-quinoxalin-4-iumone IUPAC Name: 3-(3-chlorophenyl)-1-[(3-fluorophenyl)methoxy]-4-oxidoquinoxalin-4-ium-2-one Traditional Name: 3-(3-chlorophenyl)-1-(3-fluorobenzyl)oxy-4-oxido-quinoxalin-4-ium-2-one Formula: C21H14ClFN2O3 MolecularWeight: 396.798863

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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)Cl)OCC4=CC(=CC=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C21H14ClFN2O3/c22-16-7-4-6-15(12-16)20-21(26)25(19-10-2-1-9-18(19)24(20)27)28-13-14-5-3-8-17(23)11-14/h1-12H,13H2