7-nitro-N-prop-2-ynyl-2,5-bis(trifluoromethyl)-1H-benzimidazol-4-amine

Systemtic Name: 7-nitro-N-prop-2-ynyl-2,5-bis(trifluoromethyl)-1H-benzimidazol-4-amine Openeye Name: 7-nitro-N-prop-2-ynyl-2,5-bis(trifluoromethyl)-1H-benzimidazol-4-amine CAS Name: 7-nitro-N-prop-2-ynyl-2,5-bis(trifluoromethyl)-1H-benzimidazol-4-amine IUPAC Name: 7-nitro-N-prop-2-ynyl-2,5-bis(trifluoromethyl)-1H-benzimidazol-4-amine Traditional Name: [7-nitro-2,5-bis(trifluoromethyl)-1H-benzimidazol-4-yl]-propargyl-amine Formula: C12H6F6N4O2 MolecularWeight: 352.192059

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=C2C(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC(=N2)C(F)(F)F

Isomeric SMILES

C#CCNC1=C2C(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC(=N2)C(F)(F)F

InChI

InChI=1S/C12H6F6N4O2/c1-2-3-19-7-5(11(13,14)15)4-6(22(23)24)8-9(7)21-10(20-8)12(16,17)18/h1,4,19H,3H2,(H,20,21)