cyclobutylcarbonyl-ethyl-[4-[2-(4-fluorophenyl)ethanoyl-methyl-amino]piperidin-1-yl]-phenyl-azanium

Systemtic Name: cyclobutylcarbonyl-ethyl-[4-[2-(4-fluorophenyl)ethanoyl-methyl-amino]piperidin-1-yl]-phenyl-azanium Openeye Name: cyclobutanecarbonyl-ethyl-[4-[[2-(4-fluorophenyl)acetyl]-methyl-amino]-1-piperidyl]-phenyl-ammonium CAS Name: [cyclobutyl(oxo)methyl]-ethyl-[4-[[2-(4-fluorophenyl)-1-oxoethyl]-methylamino]-1-piperidinyl]-phenylammonium IUPAC Name: cyclobutanecarbonyl-ethyl-[4-[[2-(4-fluorophenyl)acetyl]-methylamino]piperidin-1-yl]-phenylazanium Traditional Name: cyclobutanecarbonyl-ethyl-[4-[[2-(4-fluorophenyl)acetyl]-methyl-amino]piperidino]-phenyl-ammonium Formula: C27H35FN3O2+ MolecularWeight: 452.584103

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C1=CC=CC=C1)(C(=O)C2CCC2)N3CCC(CC3)N(C)C(=O)CC4=CC=C(C=C4)F

Isomeric SMILES

CC[N+](C1=CC=CC=C1)(C(=O)C2CCC2)N3CCC(CC3)N(C)C(=O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C27H35FN3O2/c1-3-31(25-10-5-4-6-11-25,27(33)22-8-7-9-22)30-18-16-24(17-19-30)29(2)26(32)20-21-12-14-23(28)15-13-21/h4-6,10-15,22,24H,3,7-9,16-20H2,1-2H3/q+1