ethyl (2S)-1-(3,4-dimethylphenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S)-1-(3,4-dimethylphenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: ethyl (2S)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid ethyl ester Formula: C15H21NO5S MolecularWeight: 327.39594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(CN1S(=O)(=O)C2=CC(=C(C=C2)C)C)O

Isomeric SMILES

CCOC(=O)[C@@H]1CC(CN1S(=O)(=O)C2=CC(=C(C=C2)C)C)O

InChI

InChI=1S/C15H21NO5S/c1-4-21-15(18)14-8-12(17)9-16(14)22(19,20)13-6-5-10(2)11(3)7-13/h5-7,12,14,17H,4,8-9H2,1-3H3/t12?,14-/m0/s1