(1-methyl-4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl) ethanoate

Systemtic Name: (1-methyl-4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl) ethanoate Openeye Name: (1-methyl-4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl) acetate CAS Name: acetic acid (1-methyl-4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl) ester IUPAC Name: (1-methyl-4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl) acetate Traditional Name: acetic acid (1-methyl-4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl) ester Formula: C14H18NO2+ MolecularWeight: 232.29822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C[NH+](CC=C1C2=CC=CC=C2)C

Isomeric SMILES

CC(=O)OC1C[NH+](CC=C1C2=CC=CC=C2)C

InChI

InChI=1S/C14H17NO2/c1-11(16)17-14-10-15(2)9-8-13(14)12-6-4-3-5-7-12/h3-8,14H,9-10H2,1-2H3/p+1