[8-fluoranyl-7-[(4-iodanyl-2-methyl-phenyl)amino]quinoxalin-6-yl] hydrogen carbonate

Systemtic Name: [8-fluoranyl-7-[(4-iodanyl-2-methyl-phenyl)amino]quinoxalin-6-yl] hydrogen carbonate Openeye Name: [8-fluoro-7-(4-iodo-2-methyl-anilino)quinoxalin-6-yl] hydrogen carbonate CAS Name: carbonic acid [8-fluoro-7-(4-iodo-2-methylanilino)-6-quinoxalinyl] ester IUPAC Name: [8-fluoro-7-(4-iodo-2-methylanilino)quinoxalin-6-yl] hydrogen carbonate Traditional Name: carbonic acid [8-fluoro-7-(4-iodo-2-methyl-anilino)quinoxalin-6-yl] ester Formula: C16H11FIN3O3 MolecularWeight: 439.179713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C=C3C(=C2F)N=CC=N3)OC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C=C3C(=C2F)N=CC=N3)OC(=O)O

InChI

InChI=1S/C16H11FIN3O3/c1-8-6-9(18)2-3-10(8)21-15-12(24-16(22)23)7-11-14(13(15)17)20-5-4-19-11/h2-7,21H,1H3,(H,22,23)