diethyl 5-(bromomethyl)-1,1-dipropyl-pyrrolidin-1-ium-3,3-dicarboxylate bromide

Systemtic Name: diethyl 5-(bromomethyl)-1,1-dipropyl-pyrrolidin-1-ium-3,3-dicarboxylate bromide Openeye Name: diethyl 5-(bromomethyl)-1,1-dipropyl-pyrrolidin-1-ium-3,3-dicarboxylate bromide CAS Name: 5-(bromomethyl)-1,1-dipropylpyrrolidin-1-ium-3,3-dicarboxylic acid diethyl ester bromide IUPAC Name: diethyl 5-(bromomethyl)-1,1-dipropylpyrrolidin-1-ium-3,3-dicarboxylate bromide Traditional Name: 5-(bromomethyl)-1,1-dipropyl-pyrrolidin-1-ium-3,3-dicarboxylic acid diethyl ester bromide Formula: C17H31Br2NO4 MolecularWeight: 473.24034

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(CC(CC1CBr)(C(=O)OCC)C(=O)OCC)CCC.[Br-]

Isomeric SMILES

CCC[N+]1(CC(CC1CBr)(C(=O)OCC)C(=O)OCC)CCC.[Br-]

InChI

InChI=1S/C17H31BrNO4.BrH/c1-5-9-19(10-6-2)13-17(11-14(19)12-18,15(20)22-7-3)16(21)23-8-4;/h14H,5-13H2,1-4H3;1H/q+1;/p-1