2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentylpentanoate bromide

Systemtic Name: 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentylpentanoate bromide Openeye Name: 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentylpentanoate bromide CAS Name: 2-cyclopentylpentanoic acid 2-(1,2,2-trimethyl-1-pyrrolidin-1-iumyl)ethyl ester bromide IUPAC Name: 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl 2-cyclopentylpentanoate bromide Traditional Name: 2-cyclopentylvaleric acid 2-(1,2,2-trimethylpyrrolidin-1-ium-1-yl)ethyl ester bromide Formula: C19H36BrNO2 MolecularWeight: 390.39864

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCCC1)C(=O)OCC[N+]2(CCCC2(C)C)C.[Br-]

Isomeric SMILES

CCCC(C1CCCC1)C(=O)OCC[N+]2(CCCC2(C)C)C.[Br-]

InChI

InChI=1S/C19H36NO2.BrH/c1-5-9-17(16-10-6-7-11-16)18(21)22-15-14-20(4)13-8-12-19(20,2)3;/h16-17H,5-15H2,1-4H3;1H/q+1;/p-1