(4-chlorophenyl) 2-pyrrolidin-1-ylpyridin-1-ium-3-carboxylate

Systemtic Name: (4-chlorophenyl) 2-pyrrolidin-1-ylpyridin-1-ium-3-carboxylate Openeye Name: (4-chlorophenyl) 2-pyrrolidin-1-ylpyridin-1-ium-3-carboxylate CAS Name: 2-(1-pyrrolidinyl)-3-pyridin-1-iumcarboxylic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) 2-pyrrolidin-1-ylpyridin-1-ium-3-carboxylate Traditional Name: 2-pyrrolidinopyridin-1-ium-3-carboxylic acid (4-chlorophenyl) ester Formula: C16H16ClN2O2+ MolecularWeight: 303.76344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H15ClN2O2/c17-12-5-7-13(8-6-12)21-16(20)14-4-3-9-18-15(14)19-10-1-2-11-19/h3-9H,1-2,10-11H2/p+1