[(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl] 3,3-dimethylbutanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]propan-2-yl] 3,3-dimethylbutanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(4-pyrrolidin-1-ylsulfonylanilino)ethyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [(2R)-1-oxo-1-[4-(1-pyrrolidinylsulfonyl)anilino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(4-pyrrolidin-1-ylsulfonylanilino)propan-2-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [(1R)-2-keto-1-methyl-2-(4-pyrrolidinosulfonylanilino)ethyl] ester Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC(=O)CC(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC(=O)CC(C)(C)C

InChI

InChI=1S/C19H28N2O5S/c1-14(26-17(22)13-19(2,3)4)18(23)20-15-7-9-16(10-8-15)27(24,25)21-11-5-6-12-21/h7-10,14H,5-6,11-13H2,1-4H3,(H,20,23)/t14-/m1/s1