4-[[5-imidazol-1-yl-2-nitro-4-(trifluoromethyl)phenyl]amino]butan-1-ol

Systemtic Name: 4-[[5-imidazol-1-yl-2-nitro-4-(trifluoromethyl)phenyl]amino]butan-1-ol Openeye Name: 4-[5-imidazol-1-yl-2-nitro-4-(trifluoromethyl)anilino]butan-1-ol CAS Name: 4-[5-(1-imidazolyl)-2-nitro-4-(trifluoromethyl)anilino]-1-butanol IUPAC Name: 4-[5-imidazol-1-yl-2-nitro-4-(trifluoromethyl)anilino]butan-1-ol Traditional Name: 4-[5-imidazol-1-yl-2-nitro-4-(trifluoromethyl)anilino]butan-1-ol Formula: C14H15F3N4O3 MolecularWeight: 344.28911

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C2=CC(=C(C=C2C(F)(F)F)[N+](=O)[O-])NCCCCO

Isomeric SMILES

C1=CN(C=N1)C2=CC(=C(C=C2C(F)(F)F)[N+](=O)[O-])NCCCCO

InChI

InChI=1S/C14H15F3N4O3/c15-14(16,17)10-7-13(21(23)24)11(19-3-1-2-6-22)8-12(10)20-5-4-18-9-20/h4-5,7-9,19,22H,1-3,6H2