[4-[(4-bromanyl-2-nitro-phenyl)amino]-2-fluoranyl-phenyl]-(4-methoxy-2-methyl-phenyl)methanone

Systemtic Name: [4-[(4-bromanyl-2-nitro-phenyl)amino]-2-fluoranyl-phenyl]-(4-methoxy-2-methyl-phenyl)methanone Openeye Name: [4-(4-bromo-2-nitro-anilino)-2-fluoro-phenyl]-(4-methoxy-2-methyl-phenyl)methanone CAS Name: [4-(4-bromo-2-nitroanilino)-2-fluorophenyl]-(4-methoxy-2-methylphenyl)methanone IUPAC Name: [4-(4-bromo-2-nitroanilino)-2-fluorophenyl]-(4-methoxy-2-methylphenyl)methanone Traditional Name: [4-(4-bromo-2-nitro-anilino)-2-fluoro-phenyl]-(4-methoxy-2-methyl-phenyl)methanone Formula: C21H16BrFN2O4 MolecularWeight: 459.265143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C(=O)C2=C(C=C(C=C2)NC3=C(C=C(C=C3)Br)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C(=O)C2=C(C=C(C=C2)NC3=C(C=C(C=C3)Br)[N+](=O)[O-])F

InChI

InChI=1S/C21H16BrFN2O4/c1-12-9-15(29-2)5-7-16(12)21(26)17-6-4-14(11-18(17)23)24-19-8-3-13(22)10-20(19)25(27)28/h3-11,24H,1-2H3