(3,3-dimethyl-2-oxidanylidene-butyl) 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-pyrrolidinosulfonyl-1H-pyrrole-2-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C15H22N2O5S MolecularWeight: 342.41058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC(=CN1)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC(=CN1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C15H22N2O5S/c1-15(2,3)13(18)10-22-14(19)12-8-11(9-16-12)23(20,21)17-6-4-5-7-17/h8-9,16H,4-7,10H2,1-3H3