(1R)-1-cyclopentyl-2-[4-[2-(2-fluorophenyl)ethyl-dimethyl-azaniumyl]piperidin-1-yl]-2-oxidanylidene-1-phenyl-ethanolate

Systemtic Name: (1R)-1-cyclopentyl-2-[4-[2-(2-fluorophenyl)ethyl-dimethyl-azaniumyl]piperidin-1-yl]-2-oxidanylidene-1-phenyl-ethanolate Openeye Name: (1R)-1-cyclopentyl-2-[4-[2-(2-fluorophenyl)ethyl-dimethyl-ammonio]-1-piperidyl]-2-oxo-1-phenyl-ethanolate CAS Name: (1R)-1-cyclopentyl-2-[4-[2-(2-fluorophenyl)ethyl-dimethylammonio]-1-piperidinyl]-2-oxo-1-phenylethanolate IUPAC Name: (1R)-1-cyclopentyl-2-[4-[2-(2-fluorophenyl)ethyl-dimethylazaniumyl]piperidin-1-yl]-2-oxo-1-phenylethanolate Traditional Name: (1R)-1-cyclopentyl-2-[4-[2-(2-fluorophenyl)ethyl-dimethyl-ammonio]piperidino]-2-keto-1-phenyl-ethanolate Formula: C28H37FN2O2 MolecularWeight: 452.603983

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=CC=CC=C1F)C2CCN(CC2)C(=O)C(C3CCCC3)(C4=CC=CC=C4)[O-]

Isomeric SMILES

C[N+](C)(CCC1=CC=CC=C1F)C2CCN(CC2)C(=O)[C@@](C3CCCC3)(C4=CC=CC=C4)[O-]

InChI

InChI=1S/C28H37FN2O2/c1-31(2,21-18-22-10-6-9-15-26(22)29)25-16-19-30(20-17-25)27(32)28(33,24-13-7-8-14-24)23-11-4-3-5-12-23/h3-6,9-12,15,24-25H,7-8,13-14,16-21H2,1-2H3/t28-/m0/s1