ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfonylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfonylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfonylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-2-[(2-methylsulfonylphenyl)-oxomethoxy]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2S)-2-(2-methylsulfonylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-(2-mesylbenzoyl)oxypropanoyl]-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)C(C)OC(=O)C2=CC=CC=C2S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@H](C)OC(=O)C2=CC=CC=C2S(=O)(=O)C)C

InChI

InChI=1S/C20H23NO7S/c1-6-27-20(24)16-11(2)17(21-12(16)3)18(22)13(4)28-19(23)14-9-7-8-10-15(14)29(5,25)26/h7-10,13,21H,6H2,1-5H3/t13-/m0/s1