1-(3-fluorophenyl)-2-methyl-N-(oxolan-2-ylmethyl)-3H-benzimidazol-1-ium-5-carboxamide

Systemtic Name: 1-(3-fluorophenyl)-2-methyl-N-(oxolan-2-ylmethyl)-3H-benzimidazol-1-ium-5-carboxamide Openeye Name: 1-(3-fluorophenyl)-2-methyl-N-(tetrahydrofuran-2-ylmethyl)-3H-benzimidazol-1-ium-5-carboxamide CAS Name: 1-(3-fluorophenyl)-2-methyl-N-(2-oxolanylmethyl)-3H-benzimidazol-1-ium-5-carboxamide IUPAC Name: 1-(3-fluorophenyl)-2-methyl-N-(oxolan-2-ylmethyl)-3H-benzimidazol-1-ium-5-carboxamide Traditional Name: 1-(3-fluorophenyl)-2-methyl-N-(tetrahydrofurfuryl)-3H-benzimidazol-1-ium-5-carboxamide Formula: C20H21FN3O2+ MolecularWeight: 354.398043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(N1)C=C(C=C2)C(=O)NCC3CCCO3)C4=CC(=CC=C4)F

Isomeric SMILES

CC1=[N+](C2=C(N1)C=C(C=C2)C(=O)NCC3CCCO3)C4=CC(=CC=C4)F

InChI

InChI=1S/C20H20FN3O2/c1-13-23-18-10-14(20(25)22-12-17-6-3-9-26-17)7-8-19(18)24(13)16-5-2-4-15(21)11-16/h2,4-5,7-8,10-11,17H,3,6,9,12H2,1H3,(H,22,25)/p+1