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

Systemtic Name: 2-(2-pyrrolidin-1-ium-1-ylethoxycarbonyl)benzoate Openeye Name: 2-(2-pyrrolidin-1-ium-1-ylethoxycarbonyl)benzoate CAS Name: 2-[oxo-[2-(1-pyrrolidin-1-iumyl)ethoxy]methyl]benzoate IUPAC Name: 2-(2-pyrrolidin-1-ium-1-ylethoxycarbonyl)benzoate Traditional Name: 2-(2-pyrrolidin-1-ium-1-ylethoxycarbonyl)benzoate Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CCOC(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H17NO4/c16-13(17)11-5-1-2-6-12(11)14(18)19-10-9-15-7-3-4-8-15/h1-2,5-6H,3-4,7-10H2,(H,16,17)