[1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 4-chloranyl-3-nitro-benzoate

Systemtic Name: [1-[bis(fluoranyl)methyl]imidazol-2-yl]methyl 4-chloranyl-3-nitro-benzoate Openeye Name: [1-(difluoromethyl)imidazol-2-yl]methyl 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid [1-(difluoromethyl)-2-imidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)imidazol-2-yl]methyl 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid [1-(difluoromethyl)imidazol-2-yl]methyl ester Formula: C12H8ClF2N3O4 MolecularWeight: 331.659426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)OCC2=NC=CN2C(F)F)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OCC2=NC=CN2C(F)F)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H8ClF2N3O4/c13-8-2-1-7(5-9(8)18(20)21)11(19)22-6-10-16-3-4-17(10)12(14)15/h1-5,12H,6H2