ethyl 4-(1,3-benzodioxol-5-yl)-1-(2-bromoethyl)-2-propyl-pyrrolidine-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-yl)-1-(2-bromoethyl)-2-propyl-pyrrolidine-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-yl)-1-(2-bromoethyl)-2-propyl-pyrrolidine-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-1-(2-bromoethyl)-2-propyl-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-yl)-1-(2-bromoethyl)-2-propylpyrrolidine-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-1-(2-bromoethyl)-2-propyl-pyrrolidine-3-carboxylic acid ethyl ester Formula: C19H26BrNO4 MolecularWeight: 412.31804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(CN1CCBr)C2=CC3=C(C=C2)OCO3)C(=O)OCC

Isomeric SMILES

CCCC1C(C(CN1CCBr)C2=CC3=C(C=C2)OCO3)C(=O)OCC

InChI

InChI=1S/C19H26BrNO4/c1-3-5-15-18(19(22)23-4-2)14(11-21(15)9-8-20)13-6-7-16-17(10-13)25-12-24-16/h6-7,10,14-15,18H,3-5,8-9,11-12H2,1-2H3