tert-butyl (2S)-1-(4-methylphenyl)sulfonyl-2-propyl-2,5-dihydropyrrole-3-carboxylate

Systemtic Name: tert-butyl (2S)-1-(4-methylphenyl)sulfonyl-2-propyl-2,5-dihydropyrrole-3-carboxylate Openeye Name: tert-butyl (2S)-2-propyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-2-propyl-2,5-dihydropyrrole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-1-(4-methylphenyl)sulfonyl-2-propyl-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S)-2-propyl-1-tosyl-3-pyrroline-3-carboxylic acid tert-butyl ester Formula: C19H27NO4S MolecularWeight: 365.48698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=CCN1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCC[C@H]1C(=CCN1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H27NO4S/c1-6-7-17-16(18(21)24-19(3,4)5)12-13-20(17)25(22,23)15-10-8-14(2)9-11-15/h8-12,17H,6-7,13H2,1-5H3/t17-/m0/s1