1-cyclopentyl-2-[4-[dimethyl(phenethyl)azaniumyl]piperidin-1-yl]-1-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethanolate

Systemtic Name: 1-cyclopentyl-2-[4-[dimethyl(phenethyl)azaniumyl]piperidin-1-yl]-1-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethanolate Openeye Name: 1-cyclopentyl-2-[4-[dimethyl(phenethyl)ammonio]-1-piperidyl]-1-(3-fluoro-4-methoxy-phenyl)-2-oxo-ethanolate CAS Name: 1-cyclopentyl-2-[4-[dimethyl(phenethyl)ammonio]-1-piperidinyl]-1-(3-fluoro-4-methoxyphenyl)-2-oxoethanolate IUPAC Name: 1-cyclopentyl-2-[4-[dimethyl(phenethyl)azaniumyl]piperidin-1-yl]-1-(3-fluoro-4-methoxyphenyl)-2-oxoethanolate Traditional Name: 1-cyclopentyl-2-[4-[dimethyl(phenethyl)ammonio]piperidino]-1-(3-fluoro-4-methoxy-phenyl)-2-keto-ethanolate Formula: C29H39FN2O3 MolecularWeight: 482.629963

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=CC=CC=C1)C2CCN(CC2)C(=O)C(C3CCCC3)(C4=CC(=C(C=C4)OC)F)[O-]

Isomeric SMILES

C[N+](C)(CCC1=CC=CC=C1)C2CCN(CC2)C(=O)C(C3CCCC3)(C4=CC(=C(C=C4)OC)F)[O-]

InChI

InChI=1S/C29H39FN2O3/c1-32(2,20-17-22-9-5-4-6-10-22)25-15-18-31(19-16-25)28(33)29(34,23-11-7-8-12-23)24-13-14-27(35-3)26(30)21-24/h4-6,9-10,13-14,21,23,25H,7-8,11-12,15-20H2,1-3H3