(2S)-1-(4-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-one

Systemtic Name: (2S)-1-(4-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-one Openeye Name: (2S)-1-(4-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-one CAS Name: (2S)-1-(4-methoxyphenyl)-2-phenyl-3-(1-pyrrolidin-1-iumyl)-1-propanone IUPAC Name: (2S)-1-(4-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-ylpropan-1-one Traditional Name: (2S)-1-(4-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-one Formula: C20H24NO2+ MolecularWeight: 310.41006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(C[NH+]2CCCC2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)[C@H](C[NH+]2CCCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO2/c1-23-18-11-9-17(10-12-18)20(22)19(15-21-13-5-6-14-21)16-7-3-2-4-8-16/h2-4,7-12,19H,5-6,13-15H2,1H3/p+1/t19-/m1/s1