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

Systemtic Name: tert-butyl (2R)-2-(1,3-benzodioxol-5-ylcarbonyl)-2-prop-2-enyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-allyl-2-(1,3-benzodioxole-5-carbonyl)pyrrolidine-1-carboxylate CAS Name: (2R)-2-[1,3-benzodioxol-5-yl(oxo)methyl]-2-prop-2-enyl-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-(1,3-benzodioxole-5-carbonyl)-2-prop-2-enylpyrrolidine-1-carboxylate Traditional Name: (2R)-2-allyl-2-piperonyloyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1(CC=C)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@@]1(CC=C)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H25NO5/c1-5-9-20(10-6-11-21(20)18(23)26-19(2,3)4)17(22)14-7-8-15-16(12-14)25-13-24-15/h5,7-8,12H,1,6,9-11,13H2,2-4H3/t20-/m0/s1