ethyl 2-[(E)-2,2-dimethylpent-3-enyl]-4-(7-methoxy-1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylate

Systemtic Name: ethyl 2-[(E)-2,2-dimethylpent-3-enyl]-4-(7-methoxy-1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylate Openeye Name: ethyl 2-[(E)-2,2-dimethylpent-3-enyl]-4-(7-methoxy-1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylate CAS Name: 2-[(E)-2,2-dimethylpent-3-enyl]-4-(7-methoxy-1,3-benzodioxol-5-yl)-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-2,2-dimethylpent-3-enyl]-4-(7-methoxy-1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylate Traditional Name: 2-[(E)-2,2-dimethylpent-3-enyl]-4-(7-methoxy-1,3-benzodioxol-5-yl)pyrrolidine-3-carboxylic acid ethyl ester Formula: C22H31NO5 MolecularWeight: 389.48524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CNC1CC(C)(C)C=CC)C2=CC3=C(C(=C2)OC)OCO3

Isomeric SMILES

CCOC(=O)C1C(CNC1CC(C)(C)/C=C/C)C2=CC3=C(C(=C2)OC)OCO3

InChI

InChI=1S/C22H31NO5/c1-6-8-22(3,4)11-16-19(21(24)26-7-2)15(12-23-16)14-9-17(25-5)20-18(10-14)27-13-28-20/h6,8-10,15-16,19,23H,7,11-13H2,1-5H3/b8-6+