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

Systemtic Name: methyl 2,4-dimethyl-5-[(2S)-2-(4-pyrrolidin-1-ylsulfonylphenyl)carbonyloxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[(2S)-2-(4-pyrrolidin-1-ylsulfonylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-1-oxo-2-[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methoxy]propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[(2S)-2-(4-pyrrolidin-1-ylsulfonylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2S)-2-(4-pyrrolidinosulfonylbenzoyl)oxypropanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C22H26N2O7S MolecularWeight: 462.51604

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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)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)[C@H](C)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H26N2O7S/c1-13-18(22(27)30-4)14(2)23-19(13)20(25)15(3)31-21(26)16-7-9-17(10-8-16)32(28,29)24-11-5-6-12-24/h7-10,15,23H,5-6,11-12H2,1-4H3/t15-/m0/s1