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

Systemtic Name: methyl 2,4-dimethyl-5-[2-(3-methylsulfonylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(3-methylsulfonylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[(3-methylsulfonylphenyl)-oxomethoxy]-1-oxopropyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(3-methylsulfonylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(3-mesylbenzoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C19H21NO7S/c1-10-15(19(23)26-4)11(2)20-16(10)17(21)12(3)27-18(22)13-7-6-8-14(9-13)28(5,24)25/h6-9,12,20H,1-5H3