ethyl (2S)-1-(3-bromanyl-5-chloranyl-2-oxidanyl-phenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S)-1-(3-bromanyl-5-chloranyl-2-oxidanyl-phenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: ethyl (2S)-1-(3-bromo-5-chloro-2-hydroxy-phenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(3-bromo-5-chloro-2-hydroxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-1-(3-bromo-5-chloro-2-hydroxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(3-bromo-5-chloro-2-hydroxy-phenyl)sulfonylpyrrolidine-2-carboxylic acid ethyl ester Formula: C13H15BrClNO5S MolecularWeight: 412.6839

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN1S(=O)(=O)C2=CC(=CC(=C2O)Br)Cl

Isomeric SMILES

CCOC(=O)[C@@H]1CCCN1S(=O)(=O)C2=CC(=CC(=C2O)Br)Cl

InChI

InChI=1S/C13H15BrClNO5S/c1-2-21-13(18)10-4-3-5-16(10)22(19,20)11-7-8(15)6-9(14)12(11)17/h6-7,10,17H,2-5H2,1H3/t10-/m0/s1