3-oxidanylidenebutan-2-yl 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (1-methyl-2-oxo-propyl) 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2-keto-1-methyl-propyl) ester Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO5S/c1-11(17)12(2)21-15(18)13-6-5-7-14(10-13)22(19,20)16-8-3-4-9-16/h5-7,10,12H,3-4,8-9H2,1-2H3