2-(1,1-dimethylpyrrolidin-1-ium-2-yl)ethyl benzoate

Systemtic Name: 2-(1,1-dimethylpyrrolidin-1-ium-2-yl)ethyl benzoate Openeye Name: 2-(1,1-dimethylpyrrolidin-1-ium-2-yl)ethyl benzoate CAS Name: benzoic acid 2-(1,1-dimethyl-2-pyrrolidin-1-iumyl)ethyl ester IUPAC Name: 2-(1,1-dimethylpyrrolidin-1-ium-2-yl)ethyl benzoate Traditional Name: benzoic acid 2-(1,1-dimethylpyrrolidin-1-ium-2-yl)ethyl ester Formula: C15H22NO2+ MolecularWeight: 248.34068

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1CCOC(=O)C2=CC=CC=C2)C

Isomeric SMILES

C[N+]1(CCCC1CCOC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C15H22NO2/c1-16(2)11-6-9-14(16)10-12-18-15(17)13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3/q+1