(2R,5S)-5-ethyl-2-(4-methylphenyl)-1-methylsulfonyl-2,5-dihydropyrrole-3-carboxylic acid

Systemtic Name: (2R,5S)-5-ethyl-2-(4-methylphenyl)-1-methylsulfonyl-2,5-dihydropyrrole-3-carboxylic acid Openeye Name: (2R,5S)-5-ethyl-1-methylsulfonyl-2-(p-tolyl)-2,5-dihydropyrrole-3-carboxylic acid CAS Name: (2R,5S)-5-ethyl-2-(4-methylphenyl)-1-methylsulfonyl-2,5-dihydropyrrole-3-carboxylic acid IUPAC Name: (2R,5S)-5-ethyl-2-(4-methylphenyl)-1-methylsulfonyl-2,5-dihydropyrrole-3-carboxylic acid Traditional Name: (2R,5S)-5-ethyl-1-mesyl-2-(p-tolyl)-3-pyrroline-3-carboxylic acid Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C=C(C(N1S(=O)(=O)C)C2=CC=C(C=C2)C)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO4S/c1-4-12-9-13(15(17)18)14(16(12)21(3,19)20)11-7-5-10(2)6-8-11/h5-9,12,14H,4H2,1-3H3,(H,17,18)/t12-,14+/m0/s1