2-(2-fluorophenyl)ethyl-dimethyl-[1-(9H-xanthen-9-ylcarbonyl)piperidin-4-yl]azanium

Systemtic Name: 2-(2-fluorophenyl)ethyl-dimethyl-[1-(9H-xanthen-9-ylcarbonyl)piperidin-4-yl]azanium Openeye Name: 2-(2-fluorophenyl)ethyl-dimethyl-[1-(9H-xanthene-9-carbonyl)-4-piperidyl]ammonium CAS Name: 2-(2-fluorophenyl)ethyl-dimethyl-[1-[oxo(9H-xanthen-9-yl)methyl]-4-piperidinyl]ammonium IUPAC Name: 2-(2-fluorophenyl)ethyl-dimethyl-[1-(9H-xanthene-9-carbonyl)piperidin-4-yl]azanium Traditional Name: 2-(2-fluorophenyl)ethyl-dimethyl-[1-(9H-xanthene-9-carbonyl)-4-piperidyl]ammonium Formula: C29H32FN2O2+ MolecularWeight: 459.574983

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=CC=CC=C1F)C2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

C[N+](C)(CCC1=CC=CC=C1F)C2CCN(CC2)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C29H32FN2O2/c1-32(2,20-17-21-9-3-6-12-25(21)30)22-15-18-31(19-16-22)29(33)28-23-10-4-7-13-26(23)34-27-14-8-5-11-24(27)28/h3-14,22,28H,15-20H2,1-2H3/q+1