2-(3-methylpyrrolidin-3-yl)-1H-benzimidazole-4-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-(3-methylpyrrolidin-3-yl)-1H-benzimidazole-4-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-(3-methylpyrrolidin-3-yl)-1H-benzimidazole-4-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: 2-(3-methyl-3-pyrrolidinyl)-1H-benzimidazole-4-carboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: 2-(3-methylpyrrolidin-3-yl)-1H-benzimidazole-4-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: 2-(3-methylpyrrolidin-3-yl)-1H-benzimidazole-4-carboxamide; 2,2,2-trifluoroacetic acid Formula: C17H18F6N4O5 MolecularWeight: 472.339039

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCNC1)C2=NC3=C(C=CC=C3N2)C(=O)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1(CCNC1)C2=NC3=C(C=CC=C3N2)C(=O)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H16N4O.2C2HF3O2/c1-13(5-6-15-7-13)12-16-9-4-2-3-8(11(14)18)10(9)17-12;2*3-2(4,5)1(6)7/h2-4,15H,5-7H2,1H3,(H2,14,18)(H,16,17);2*(H,6,7)