tert-butyl (2R)-2-(1,3-benzodioxol-5-ylcarbonyl)-2-(2-oxidanylidenepropyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-(1,3-benzodioxol-5-ylcarbonyl)-2-(2-oxidanylidenepropyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-acetonyl-2-(1,3-benzodioxole-5-carbonyl)pyrrolidine-1-carboxylate CAS Name: (2R)-2-[1,3-benzodioxol-5-yl(oxo)methyl]-2-(2-oxopropyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-(1,3-benzodioxole-5-carbonyl)-2-(2-oxopropyl)pyrrolidine-1-carboxylate Traditional Name: (2R)-2-acetonyl-2-piperonyloyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1(CCCN1C(=O)OC(C)(C)C)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)C[C@]1(CCCN1C(=O)OC(C)(C)C)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H25NO6/c1-13(22)11-20(8-5-9-21(20)18(24)27-19(2,3)4)17(23)14-6-7-15-16(10-14)26-12-25-15/h6-7,10H,5,8-9,11-12H2,1-4H3/t20-/m1/s1