2-[3-[1-[1-(2-fluorophenyl)piperidin-4-yl]piperidin-1-ium-4-yl]propanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[1-[1-(2-fluorophenyl)piperidin-4-yl]piperidin-1-ium-4-yl]propanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[3-[1-[1-(2-fluorophenyl)-4-piperidyl]piperidin-1-ium-4-yl]propanoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[3-[1-[1-(2-fluorophenyl)-4-piperidinyl]-4-piperidin-1-iumyl]-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[3-[1-[1-(2-fluorophenyl)piperidin-4-yl]piperidin-1-ium-4-yl]propanoylamino]ethyl-dimethylazanium Traditional Name: 2-[3-[1-[1-(2-fluorophenyl)-4-piperidyl]piperidin-1-ium-4-yl]propanoylamino]ethyl-dimethyl-ammonium Formula: C23H39FN4O+2 MolecularWeight: 406.580363

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CCC1CC[NH+](CC1)C2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

C[NH+](C)CCNC(=O)CCC1CC[NH+](CC1)C2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C23H37FN4O/c1-26(2)18-13-25-23(29)8-7-19-9-14-27(15-10-19)20-11-16-28(17-12-20)22-6-4-3-5-21(22)24/h3-6,19-20H,7-18H2,1-2H3,(H,25,29)/p+2