(2R,3S,5S)-2-(2-fluoranyl-5-methoxy-phenyl)-5-methoxycarbonyl-1-methyl-pyrrolidine-3-carboxylic acid

Systemtic Name: (2R,3S,5S)-2-(2-fluoranyl-5-methoxy-phenyl)-5-methoxycarbonyl-1-methyl-pyrrolidine-3-carboxylic acid Openeye Name: (2R,3S,5S)-2-(2-fluoro-5-methoxy-phenyl)-5-methoxycarbonyl-1-methyl-pyrrolidine-3-carboxylic acid CAS Name: (2R,3S,5S)-2-(2-fluoro-5-methoxyphenyl)-5-methoxycarbonyl-1-methyl-3-pyrrolidinecarboxylic acid IUPAC Name: (2R,3S,5S)-2-(2-fluoro-5-methoxyphenyl)-5-methoxycarbonyl-1-methylpyrrolidine-3-carboxylic acid Traditional Name: (2R,3S,5S)-5-carbomethoxy-2-(2-fluoro-5-methoxy-phenyl)-1-methyl-pyrrolidine-3-carboxylic acid Formula: C15H18FNO5 MolecularWeight: 311.305523

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(C1C2=C(C=CC(=C2)OC)F)C(=O)O)C(=O)OC

Isomeric SMILES

CN1[C@@H](C[C@@H]([C@@H]1C2=C(C=CC(=C2)OC)F)C(=O)O)C(=O)OC

InChI

InChI=1S/C15H18FNO5/c1-17-12(15(20)22-3)7-10(14(18)19)13(17)9-6-8(21-2)4-5-11(9)16/h4-6,10,12-13H,7H2,1-3H3,(H,18,19)/t10-,12-,13-/m0/s1