2-[4-fluoranyl-2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-phenyl]-1,2-oxazol-5-one

Systemtic Name: 2-[4-fluoranyl-2-[(4-iodanyl-2-methyl-phenyl)amino]-5-nitro-phenyl]-1,2-oxazol-5-one Openeye Name: 2-[4-fluoro-2-(4-iodo-2-methyl-anilino)-5-nitro-phenyl]isoxazol-5-one CAS Name: 2-[4-fluoro-2-(4-iodo-2-methylanilino)-5-nitrophenyl]-5-isoxazolone IUPAC Name: 2-[4-fluoro-2-(4-iodo-2-methylanilino)-5-nitrophenyl]-1,2-oxazol-5-one Traditional Name: 2-[4-fluoro-2-(4-iodo-2-methyl-anilino)-5-nitro-phenyl]-3-isoxazolin-5-one Formula: C16H11FIN3O4 MolecularWeight: 455.179113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=CC(=C(C=C2N3C=CC(=O)O3)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=CC(=C(C=C2N3C=CC(=O)O3)[N+](=O)[O-])F

InChI

InChI=1S/C16H11FIN3O4/c1-9-6-10(18)2-3-12(9)19-13-7-11(17)14(21(23)24)8-15(13)20-5-4-16(22)25-20/h2-8,19H,1H3