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

Systemtic Name: (2S)-1-(3-fluoranyl-4-methoxy-phenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-one Openeye Name: (2S)-1-(3-fluoro-4-methoxy-phenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-one CAS Name: (2S)-1-(3-fluoro-4-methoxyphenyl)-2-phenyl-3-(1-pyrrolidin-1-iumyl)-1-propanone IUPAC Name: (2S)-1-(3-fluoro-4-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ium-1-ylpropan-1-one Traditional Name: (2S)-1-(3-fluoro-4-methoxy-phenyl)-2-phenyl-3-pyrrolidin-1-ium-1-yl-propan-1-one Formula: C20H23FNO2+ MolecularWeight: 328.400523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FNO2/c1-24-19-10-9-16(13-18(19)21)20(23)17(14-22-11-5-6-12-22)15-7-3-2-4-8-15/h2-4,7-10,13,17H,5-6,11-12,14H2,1H3/p+1/t17-/m1/s1