methyl 2,4-dimethyl-5-[2-(3-pyrrolidin-1-ylsulfonylphenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-(3-pyrrolidin-1-ylsulfonylphenyl)carbonyloxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(3-pyrrolidin-1-ylsulfonylbenzoyl)oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methoxy]ethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(3-pyrrolidin-1-ylsulfonylbenzoyl)oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(3-pyrrolidinosulfonylbenzoyl)oxyacetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O7S/c1-13-18(21(26)29-3)14(2)22-19(13)17(24)12-30-20(25)15-7-6-8-16(11-15)31(27,28)23-9-4-5-10-23/h6-8,11,22H,4-5,9-10,12H2,1-3H3