1-(3-chloranyl-2-fluoranyl-phenyl)sulfonyl-4-methoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-chloranyl-2-fluoranyl-phenyl)sulfonyl-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-chloro-2-fluoro-phenyl)sulfonyl-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-(3-chloro-2-fluorophenyl)sulfonyl-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-chloro-2-fluorophenyl)sulfonyl-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: 1-(3-chloro-2-fluoro-phenyl)sulfonyl-4-methoxy-proline Formula: C12H13ClFNO5S MolecularWeight: 337.751723

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)S(=O)(=O)C2=C(C(=CC=C2)Cl)F)C(=O)O

Isomeric SMILES

COC1CC(N(C1)S(=O)(=O)C2=C(C(=CC=C2)Cl)F)C(=O)O

InChI

InChI=1S/C12H13ClFNO5S/c1-20-7-5-9(12(16)17)15(6-7)21(18,19)10-4-2-3-8(13)11(10)14/h2-4,7,9H,5-6H2,1H3,(H,16,17)