ethyl (2R,5S)-5-ethenyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2R,5S)-5-ethenyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: ethyl (2R,5S)-1-(p-tolylsulfonyl)-5-vinyl-pyrrolidine-2-carboxylate CAS Name: (2R,5S)-5-ethenyl-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,5S)-5-ethenyl-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,5S)-1-tosyl-5-vinyl-pyrrolidine-2-carboxylic acid ethyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(N1S(=O)(=O)C2=CC=C(C=C2)C)C=C

Isomeric SMILES

CCOC(=O)[C@H]1CC[C@H](N1S(=O)(=O)C2=CC=C(C=C2)C)C=C

InChI

InChI=1S/C16H21NO4S/c1-4-13-8-11-15(16(18)21-5-2)17(13)22(19,20)14-9-6-12(3)7-10-14/h4,6-7,9-10,13,15H,1,5,8,11H2,2-3H3/t13-,15-/m1/s1