(phenylmethyl) 1,1-dimethyl-3,6-dihydro-2H-pyridin-1-ium-5-carboxylate

Systemtic Name: (phenylmethyl) 1,1-dimethyl-3,6-dihydro-2H-pyridin-1-ium-5-carboxylate Openeye Name: benzyl 1,1-dimethyl-3,6-dihydro-2H-pyridin-1-ium-5-carboxylate CAS Name: 1,1-dimethyl-3,6-dihydro-2H-pyridin-1-ium-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1,1-dimethyl-3,6-dihydro-2H-pyridin-1-ium-5-carboxylate Traditional Name: 1,1-dimethyl-3,6-dihydro-2H-pyridin-1-ium-5-carboxylic acid benzyl ester Formula: C15H20NO2+ MolecularWeight: 246.3248

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC=C(C1)C(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

C[N+]1(CCC=C(C1)C(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C15H20NO2/c1-16(2)10-6-9-14(11-16)15(17)18-12-13-7-4-3-5-8-13/h3-5,7-9H,6,10-12H2,1-2H3/q+1