ethyl 2,4-dimethyl-5-[2-(2-methyl-5-methylsulfonyl-phenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(2-methyl-5-methylsulfonyl-phenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-(2-methyl-5-methylsulfonyl-benzoyl)oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[(2-methyl-5-methylsulfonylphenyl)-oxomethoxy]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(2-methyl-5-methylsulfonylbenzoyl)oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(5-mesyl-2-methyl-benzoyl)oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H23NO7S MolecularWeight: 421.46412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)C)C

InChI

InChI=1S/C20H23NO7S/c1-6-27-20(24)17-12(3)18(21-13(17)4)16(22)10-28-19(23)15-9-14(29(5,25)26)8-7-11(15)2/h7-9,21H,6,10H2,1-5H3