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

Systemtic Name: ethyl 1-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane-3-carboxylate hydrobromide Openeye Name: ethyl 1-benzyl-1-azoniabicyclo[2.2.1]heptane-3-carboxylate hydrobromide CAS Name: 1-(phenylmethyl)-1-azoniabicyclo[2.2.1]heptane-3-carboxylic acid ethyl ester hydrobromide IUPAC Name: ethyl 1-benzyl-1-azoniabicyclo[2.2.1]heptane-3-carboxylate hydrobromide Traditional Name: 1-benzyl-1-azoniabicyclo[2.2.1]heptane-3-carboxylic acid ethyl ester hydrobromide Formula: C16H23BrNO2+ MolecularWeight: 341.26332

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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;