3-(4-iodophenyl)-4-oxidanidyl-1-(pyridin-2-ylmethoxy)quinoxalin-4-ium-2-one

Systemtic Name: 3-(4-iodophenyl)-4-oxidanidyl-1-(pyridin-2-ylmethoxy)quinoxalin-4-ium-2-one Openeye Name: 3-(4-iodophenyl)-4-oxido-1-(2-pyridylmethoxy)quinoxalin-4-ium-2-one CAS Name: 3-(4-iodophenyl)-4-oxido-1-(2-pyridinylmethoxy)-2-quinoxalin-4-iumone IUPAC Name: 3-(4-iodophenyl)-4-oxido-1-(pyridin-2-ylmethoxy)quinoxalin-4-ium-2-one Traditional Name: 3-(4-iodophenyl)-4-oxido-1-(2-pyridylmethoxy)quinoxalin-4-ium-2-one Formula: C20H14IN3O3 MolecularWeight: 471.24793

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)C(=[N+]2[O-])C3=CC=C(C=C3)I)OCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)C(=[N+]2[O-])C3=CC=C(C=C3)I)OCC4=CC=CC=N4

InChI

InChI=1S/C20H14IN3O3/c21-15-10-8-14(9-11-15)19-20(25)24(27-13-16-5-3-4-12-22-16)18-7-2-1-6-17(18)23(19)26/h1-12H,13H2