diethyl 5-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 5-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 5-[(4-chloro-3-morpholinosulfonyl-benzoyl)oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[[[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-oxomethoxy]methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(4-chloro-3-morpholin-4-ylsulfonylbenzoyl)oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[(4-chloro-3-morpholinosulfonyl-benzoyl)oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C23H27ClN2O9S MolecularWeight: 542.98648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C23H27ClN2O9S/c1-4-33-22(28)19-14(3)20(23(29)34-5-2)25-17(19)13-35-21(27)15-6-7-16(24)18(12-15)36(30,31)26-8-10-32-11-9-26/h6-7,12,25H,4-5,8-11,13H2,1-3H3