1-(4-methylphenyl)sulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)sulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid Openeye Name: 2-phenyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylic acid CAS Name: 1-(4-methylphenyl)sulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid IUPAC Name: 1-(4-methylphenyl)sulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid Traditional Name: 2-phenyl-1-tosyl-3-pyrroline-3-carboxylic acid Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC=C(C2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC=C(C2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H17NO4S/c1-13-7-9-15(10-8-13)24(22,23)19-12-11-16(18(20)21)17(19)14-5-3-2-4-6-14/h2-11,17H,12H2,1H3,(H,20,21)