N-[(5-fluoranyl-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3-iodanyl-N-propyl-benzamide

Systemtic Name: N-[(5-fluoranyl-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3-iodanyl-N-propyl-benzamide Openeye Name: N-[(5-fluoro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3-iodo-N-propyl-benzamide CAS Name: N-[(5-fluoro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3-iodo-N-propylbenzamide IUPAC Name: N-[(5-fluoro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3-iodo-N-propylbenzamide Traditional Name: N-[(5-fluoro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3-iodo-N-propyl-benzamide Formula: C21H24FIN3O+ MolecularWeight: 480.337633

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(NC2=C1C=C(C=C2)F)CN(CCC)C(=O)C3=CC(=CC=C3)I

Isomeric SMILES

CCC[N+]1=C(NC2=C1C=C(C=C2)F)CN(CCC)C(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C21H23FIN3O/c1-3-10-25(21(27)15-6-5-7-17(23)12-15)14-20-24-18-9-8-16(22)13-19(18)26(20)11-4-2/h5-9,12-13H,3-4,10-11,14H2,1-2H3/p+1