(phenylmethyl) 4-(dimethylamino)pyridin-1-ium-1-carboxylate chloride

Systemtic Name: (phenylmethyl) 4-(dimethylamino)pyridin-1-ium-1-carboxylate chloride Openeye Name: benzyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate chloride CAS Name: 4-(dimethylamino)-1-pyridin-1-iumcarboxylic acid (phenylmethyl) ester chloride IUPAC Name: benzyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate chloride Traditional Name: 4-(dimethylamino)pyridin-1-ium-1-carboxylic acid benzyl ester chloride Formula: C15H17ClN2O2 MolecularWeight: 292.76068

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)C(=O)OCC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)C(=O)OCC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C15H17N2O2.ClH/c1-16(2)14-8-10-17(11-9-14)15(18)19-12-13-6-4-3-5-7-13;/h3-11H,12H2,1-2H3;1H/q+1;/p-1