3-bromanyl-2-(3-fluoranyl-4-methyl-phenyl)-1-methyl-2-nitro-3-(trifluoromethyl)pyrrole

Systemtic Name: 3-bromanyl-2-(3-fluoranyl-4-methyl-phenyl)-1-methyl-2-nitro-3-(trifluoromethyl)pyrrole Openeye Name: 3-bromo-2-(3-fluoro-4-methyl-phenyl)-1-methyl-2-nitro-3-(trifluoromethyl)pyrrole CAS Name: 3-bromo-2-(3-fluoro-4-methylphenyl)-1-methyl-2-nitro-3-(trifluoromethyl)pyrrole IUPAC Name: 3-bromo-2-(3-fluoro-4-methylphenyl)-1-methyl-2-nitro-3-(trifluoromethyl)pyrrole Traditional Name: 3-bromo-2-(3-fluoro-4-methyl-phenyl)-1-methyl-2-nitro-3-(trifluoromethyl)-2-pyrroline Formula: C13H11BrF4N2O2 MolecularWeight: 383.136253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2(C(C=CN2C)(C(F)(F)F)Br)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)C2(C(C=CN2C)(C(F)(F)F)Br)[N+](=O)[O-])F

InChI

InChI=1S/C13H11BrF4N2O2/c1-8-3-4-9(7-10(8)15)12(20(21)22)11(14,13(16,17)18)5-6-19(12)2/h3-7H,1-2H3