methyl 5-[2-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyloxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonyloxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethoxy]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(2-chloro-5-pyrrolidinosulfonyl-benzoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H25ClN2O7S MolecularWeight: 496.9611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)Cl

InChI

InChI=1S/C22H25ClN2O7S/c1-12-18(22(28)31-4)13(2)24-19(12)20(26)14(3)32-21(27)16-11-15(7-8-17(16)23)33(29,30)25-9-5-6-10-25/h7-8,11,14,24H,5-6,9-10H2,1-4H3