1-methylsulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid

Systemtic Name: 1-methylsulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid Openeye Name: 1-methylsulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid CAS Name: 1-methylsulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid IUPAC Name: 1-methylsulfonyl-2-phenyl-2,5-dihydropyrrole-3-carboxylic acid Traditional Name: 1-mesyl-2-phenyl-3-pyrroline-3-carboxylic acid Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC=C(C1C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CC=C(C1C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C12H13NO4S/c1-18(16,17)13-8-7-10(12(14)15)11(13)9-5-3-2-4-6-9/h2-7,11H,8H2,1H3,(H,14,15)