tributyl-[2-[[4-(4-fluorophenyl)-1-pentyl-piperidin-3-yl]methylamino]ethyl]azanium

Systemtic Name: tributyl-[2-[[4-(4-fluorophenyl)-1-pentyl-piperidin-3-yl]methylamino]ethyl]azanium Openeye Name: tributyl-[2-[[4-(4-fluorophenyl)-1-pentyl-3-piperidyl]methylamino]ethyl]ammonium CAS Name: tributyl-[2-[[4-(4-fluorophenyl)-1-pentyl-3-piperidinyl]methylamino]ethyl]ammonium IUPAC Name: tributyl-[2-[[4-(4-fluorophenyl)-1-pentylpiperidin-3-yl]methylamino]ethyl]azanium Traditional Name: 2-[[1-amyl-4-(4-fluorophenyl)-3-piperidyl]methylamino]ethyl-tributyl-ammonium Formula: C31H57FN3+ MolecularWeight: 490.802783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(C(C1)CNCC[N+](CCCC)(CCCC)CCCC)C2=CC=C(C=C2)F

Isomeric SMILES

CCCCCN1CCC(C(C1)CNCC[N+](CCCC)(CCCC)CCCC)C2=CC=C(C=C2)F

InChI

InChI=1S/C31H57FN3/c1-5-9-13-20-34-21-18-31(28-14-16-30(32)17-15-28)29(27-34)26-33-19-25-35(22-10-6-2,23-11-7-3)24-12-8-4/h14-17,29,31,33H,5-13,18-27H2,1-4H3/q+1