[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl] 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)pyrrolidine-2-carboxylate

Systemtic Name: [(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl] 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)pyrrolidine-2-carboxylate Openeye Name: [(E)-3-(1,3-benzodioxol-5-yl)allyl] 1-(3,3-dimethyl-2-oxo-pentanoyl)pyrrolidine-2-carboxylate CAS Name: 1-(3,3-dimethyl-1,2-dioxopentyl)-2-pyrrolidinecarboxylic acid [(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl] ester IUPAC Name: [(E)-3-(1,3-benzodioxol-5-yl)prop-2-enyl] 1-(3,3-dimethyl-2-oxopentanoyl)pyrrolidine-2-carboxylate Traditional Name: 1-(2-keto-3,3-dimethyl-pentanoyl)pyrrolidine-2-carboxylic acid [(E)-3-(1,3-benzodioxol-5-yl)allyl] ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)OCC=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)OC/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H27NO6/c1-4-22(2,3)19(24)20(25)23-11-5-8-16(23)21(26)27-12-6-7-15-9-10-17-18(13-15)29-14-28-17/h6-7,9-10,13,16H,4-5,8,11-12,14H2,1-3H3/b7-6+