N-[(5-chloranyl-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3,4-bis(fluoranyl)-N-propyl-benzamide

Systemtic Name: N-[(5-chloranyl-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3,4-bis(fluoranyl)-N-propyl-benzamide Openeye Name: N-[(5-chloro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3,4-difluoro-N-propyl-benzamide CAS Name: N-[(5-chloro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3,4-difluoro-N-propylbenzamide IUPAC Name: N-[(5-chloro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3,4-difluoro-N-propylbenzamide Traditional Name: N-[(5-chloro-3-propyl-1H-benzimidazol-3-ium-2-yl)methyl]-3,4-difluoro-N-propyl-benzamide Formula: C21H23ClF2N3O+ MolecularWeight: 406.876626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClF2N3O/c1-3-9-26(21(28)14-5-7-16(23)17(24)11-14)13-20-25-18-8-6-15(22)12-19(18)27(20)10-4-2/h5-8,11-12H,3-4,9-10,13H2,1-2H3/p+1