methyl (2S)-1-[2,6-bis(fluoranyl)phenyl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-[2,6-bis(fluoranyl)phenyl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-(2,6-difluorobenzoyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2,6-difluorophenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-(2,6-difluorobenzoyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2,6-difluorobenzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C13H13F2NO3 MolecularWeight: 269.244026

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C2=C(C=CC=C2F)F

Isomeric SMILES

COC(=O)[C@@H]1CCCN1C(=O)C2=C(C=CC=C2F)F

InChI

InChI=1S/C13H13F2NO3/c1-19-13(18)10-6-3-7-16(10)12(17)11-8(14)4-2-5-9(11)15/h2,4-5,10H,3,6-7H2,1H3/t10-/m0/s1