ethyl 1-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane-3-carboxylate bromide

Systemtic Name: ethyl 1-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane-3-carboxylate bromide Openeye Name: ethyl 1-benzyl-1-azoniabicyclo[2.2.1]heptane-3-carboxylate bromide CAS Name: 1-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane-3-carboxylic acid ethyl ester bromide IUPAC Name: ethyl 1-benzyl-1-azoniabicyclo[2.2.1]heptane-3-carboxylate bromide Traditional Name: 1-benzyl-1-azoniabicyclo[2.2.1]heptane-3-carboxylic acid ethyl ester bromide Formula: C16H22BrNO2 MolecularWeight: 340.25538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C[N+]2(CCC1C2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

CCOC(=O)C1C[N+]2(CCC1C2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C16H22NO2.BrH/c1-2-19-16(18)15-12-17(9-8-14(15)11-17)10-13-6-4-3-5-7-13;/h3-7,14-15H,2,8-12H2,1H3;1H/q+1;/p-1