tert-butyl 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[(E)-3-(1,3-benzodioxol-5-yl)allyl]pyrrolidine-2-carboxylate CAS Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl]pyrrolidine-2-carboxylate Traditional Name: 1-[(E)-3-(1,3-benzodioxol-5-yl)allyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1CC=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)C1CCCN1C/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H25NO4/c1-19(2,3)24-18(21)15-7-5-11-20(15)10-4-6-14-8-9-16-17(12-14)23-13-22-16/h4,6,8-9,12,15H,5,7,10-11,13H2,1-3H3/b6-4+