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

Systemtic Name: (phenylmethyl) 4-(dimethylamino)pyridin-1-ium-1-carboxylate Openeye Name: benzyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate CAS Name: 4-(dimethylamino)-1-pyridin-1-iumcarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate Traditional Name: 4-(dimethylamino)pyridin-1-ium-1-carboxylic acid benzyl ester Formula: C15H17N2O2+ MolecularWeight: 257.30768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N2O2/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/q+1