(3-morpholin-4-ylsulfonylphenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC(=O)C1=CN(C(=C1)C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C19H22N2O6S/c1-14(22)16-11-18(20(2)12-16)19(23)27-13-15-4-3-5-17(10-15)28(24,25)21-6-8-26-9-7-21/h3-5,10-12H,6-9,13H2,1-2H3