methyl 3-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)benzoate

Systemtic Name: methyl 3-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)benzoate Openeye Name: methyl 3-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)benzoate CAS Name: 3-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)benzoic acid methyl ester IUPAC Name: methyl 3-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)benzoate Traditional Name: 3-(1-aza-4-azoniabicyclo[2.2.2]octan-4-ylmethyl)benzoic acid methyl ester Formula: C15H21N2O2+ MolecularWeight: 261.33944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C[N+]23CCN(CC2)CC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C[N+]23CCN(CC2)CC3

InChI

InChI=1S/C15H21N2O2/c1-19-15(18)14-4-2-3-13(11-14)12-17-8-5-16(6-9-17)7-10-17/h2-4,11H,5-10,12H2,1H3/q+1