7-nitro-4-(propylamino)-2-(trifluoromethyl)-1H-benzimidazole-5-carbonitrile

Systemtic Name: 7-nitro-4-(propylamino)-2-(trifluoromethyl)-1H-benzimidazole-5-carbonitrile Openeye Name: 7-nitro-4-(propylamino)-2-(trifluoromethyl)-1H-benzimidazole-5-carbonitrile CAS Name: 7-nitro-4-(propylamino)-2-(trifluoromethyl)-1H-benzimidazole-5-carbonitrile IUPAC Name: 7-nitro-4-(propylamino)-2-(trifluoromethyl)-1H-benzimidazole-5-carbonitrile Traditional Name: 7-nitro-4-(propylamino)-2-(trifluoromethyl)-1H-benzimidazole-5-carbonitrile Formula: C12H10F3N5O2 MolecularWeight: 313.23531

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C2C(=C(C=C1C#N)[N+](=O)[O-])NC(=N2)C(F)(F)F

Isomeric SMILES

CCCNC1=C2C(=C(C=C1C#N)[N+](=O)[O-])NC(=N2)C(F)(F)F

InChI

InChI=1S/C12H10F3N5O2/c1-2-3-17-8-6(5-16)4-7(20(21)22)9-10(8)19-11(18-9)12(13,14)15/h4,17H,2-3H2,1H3,(H,18,19)