N-[[4-[bis(fluoranyl)methoxy]phenyl]methyl]-N,3-dimethyl-5-nitro-imidazol-4-amine

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]phenyl]methyl]-N,3-dimethyl-5-nitro-imidazol-4-amine Openeye Name: N-[[4-(difluoromethoxy)phenyl]methyl]-N,3-dimethyl-5-nitro-imidazol-4-amine CAS Name: N-[[4-(difluoromethoxy)phenyl]methyl]-N,3-dimethyl-5-nitro-4-imidazolamine IUPAC Name: N-[[4-(difluoromethoxy)phenyl]methyl]-N,3-dimethyl-5-nitroimidazol-4-amine Traditional Name: [4-(difluoromethoxy)benzyl]-methyl-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C13H14F2N4O3 MolecularWeight: 312.272066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N(C)CC2=CC=C(C=C2)OC(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N(C)CC2=CC=C(C=C2)OC(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H14F2N4O3/c1-17(12-11(19(20)21)16-8-18(12)2)7-9-3-5-10(6-4-9)22-13(14)15/h3-6,8,13H,7H2,1-2H3