methyl 5-[(2S)-2-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[(2S)-2-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonyloxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[(2S)-2-(4-fluoro-3-morpholinosulfonyl-benzoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2S)-2-[[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]-oxomethoxy]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[(2S)-2-(4-fluoro-3-morpholin-4-ylsulfonylbenzoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2S)-2-(4-fluoro-3-morpholinosulfonyl-benzoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H25FN2O8S MolecularWeight: 496.505903

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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(=C(C=C2)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)OC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H25FN2O8S/c1-12-18(22(28)31-4)13(2)24-19(12)20(26)14(3)33-21(27)15-5-6-16(23)17(11-15)34(29,30)25-7-9-32-10-8-25/h5-6,11,14,24H,7-10H2,1-4H3/t14-/m0/s1