(3,3-dimethyl-2-oxidanylidene-butyl) 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-2-pyrrolidinecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylate Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)pyrrolidine-2-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H25NO7S MolecularWeight: 411.4693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1CCCN1S(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H25NO7S/c1-19(2,3)17(21)12-27-18(22)14-5-4-8-20(14)28(23,24)13-6-7-15-16(11-13)26-10-9-25-15/h6-7,11,14H,4-5,8-10,12H2,1-3H3