tert-butyl 3-ethyl-4-methyl-2-(4-methylphenyl)sulfonyl-5-oxidanylidene-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3-ethyl-4-methyl-2-(4-methylphenyl)sulfonyl-5-oxidanylidene-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl 3-ethyl-4-methyl-5-oxo-2-(p-tolylsulfonyl)-2H-pyrrole-1-carboxylate CAS Name: 3-ethyl-4-methyl-2-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethyl-4-methyl-2-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrole-1-carboxylate Traditional Name: 4-ethyl-2-keto-3-methyl-5-tosyl-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(C1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCC1=C(C(=O)N(C1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C19H25NO5S/c1-7-15-13(3)16(21)20(18(22)25-19(4,5)6)17(15)26(23,24)14-10-8-12(2)9-11-14/h8-11,17H,7H2,1-6H3