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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO7S/c1-5-26-19(23)16-11(2)17(20-12(16)3)15(21)10-27-18(22)13-7-6-8-14(9-13)28(4,24)25/h6-9,20H,5,10H2,1-4H3