ethyl 1-(phenylmethyl)-1-azoniabicyclo[3.2.1]octane-5-carboxylate bromide

Systemtic Name: ethyl 1-(phenylmethyl)-1-azoniabicyclo[3.2.1]octane-5-carboxylate bromide Openeye Name: ethyl 1-benzyl-1-azoniabicyclo[3.2.1]octane-5-carboxylate bromide CAS Name: 1-(phenylmethyl)-1-azoniabicyclo[3.2.1]octane-5-carboxylic acid ethyl ester bromide IUPAC Name: ethyl 1-benzyl-1-azoniabicyclo[3.2.1]octane-5-carboxylate bromide Traditional Name: 1-benzyl-1-azoniabicyclo[3.2.1]octane-5-carboxylic acid ethyl ester bromide Formula: C17H24BrNO2 MolecularWeight: 354.28196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CCC[N+](C1)(CC2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

CCOC(=O)C12CCC[N+](C1)(CC2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C17H24NO2.BrH/c1-2-20-16(19)17-9-6-11-18(14-17,12-10-17)13-15-7-4-3-5-8-15;/h3-5,7-8H,2,6,9-14H2,1H3;1H/q+1;/p-1