(3-fluoranyl-4-methoxy-phenyl)methyl (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(4-fluorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C19H19F2NO5S MolecularWeight: 411.419666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)F)F

InChI

InChI=1S/C19H19F2NO5S/c1-26-18-9-4-13(11-16(18)21)12-27-19(23)17-3-2-10-22(17)28(24,25)15-7-5-14(20)6-8-15/h4-9,11,17H,2-3,10,12H2,1H3/t17-/m0/s1