2-(4-methoxyphenyl)-1-(phenylsulfonyl)-2,5-dihydropyrrole-3-carboxylic acid

Systemtic Name: 2-(4-methoxyphenyl)-1-(phenylsulfonyl)-2,5-dihydropyrrole-3-carboxylic acid Openeye Name: 1-(benzenesulfonyl)-2-(4-methoxyphenyl)-2,5-dihydropyrrole-3-carboxylic acid CAS Name: 1-(benzenesulfonyl)-2-(4-methoxyphenyl)-2,5-dihydropyrrole-3-carboxylic acid IUPAC Name: 1-(benzenesulfonyl)-2-(4-methoxyphenyl)-2,5-dihydropyrrole-3-carboxylic acid Traditional Name: 1-besyl-2-(4-methoxyphenyl)-3-pyrroline-3-carboxylic acid Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=CCN2S(=O)(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2C(=CCN2S(=O)(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H17NO5S/c1-24-14-9-7-13(8-10-14)17-16(18(20)21)11-12-19(17)25(22,23)15-5-3-2-4-6-15/h2-11,17H,12H2,1H3,(H,20,21)