3-[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-1,4-dimethyl-piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one

Systemtic Name: 3-[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]-1,4-dimethyl-piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one Openeye Name: 3-[1-[4-(4-fluorophenyl)-4-oxo-butyl]-1,4-dimethyl-piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one CAS Name: 3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-1,4-dimethyl-4-piperidin-1-iumyl]-3-methyl-1H-benzimidazol-3-ium-2-one IUPAC Name: 3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-1,4-dimethylpiperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one Traditional Name: 3-[1-[4-(4-fluorophenyl)-4-keto-butyl]-1,4-dimethyl-piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one Formula: C25H32FN3O2+2 MolecularWeight: 425.538883

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC[N+](CC1)(C)CCCC(=O)C2=CC=C(C=C2)F)[N+]3(C4=CC=CC=C4NC3=O)C

Isomeric SMILES

CC1(CC[N+](CC1)(C)CCCC(=O)C2=CC=C(C=C2)F)[N+]3(C4=CC=CC=C4NC3=O)C

InChI

InChI=1S/C25H31FN3O2/c1-25(29(3)22-8-5-4-7-21(22)27-24(29)31)14-17-28(2,18-15-25)16-6-9-23(30)19-10-12-20(26)13-11-19/h4-5,7-8,10-13H,6,9,14-18H2,1-3H3/q+1/p+1