5-chloranyl-N-(3-imidazol-1-ylpropyl)-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: 5-chloranyl-N-(3-imidazol-1-ylpropyl)-2-nitro-4-(trifluoromethyl)aniline Openeye Name: 5-chloro-N-(3-imidazol-1-ylpropyl)-2-nitro-4-(trifluoromethyl)aniline CAS Name: 5-chloro-N-[3-(1-imidazolyl)propyl]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: 5-chloro-N-(3-imidazol-1-ylpropyl)-2-nitro-4-(trifluoromethyl)aniline Traditional Name: [5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-(3-imidazol-1-ylpropyl)amine Formula: C13H12ClF3N4O2 MolecularWeight: 348.70819

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCCNC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C=N1)CCCNC2=C(C=C(C(=C2)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H12ClF3N4O2/c14-10-7-11(19-2-1-4-20-5-3-18-8-20)12(21(22)23)6-9(10)13(15,16)17/h3,5-8,19H,1-2,4H2