2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate

Systemtic Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate Openeye Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate CAS Name: 2-[2-(1-pyrrolidin-1-iumyl)ethoxy]benzoate IUPAC Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate Traditional Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCOC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C13H17NO3/c15-13(16)11-5-1-2-6-12(11)17-10-9-14-7-3-4-8-14/h1-2,5-6H,3-4,7-10H2,(H,15,16)