3-(4-methylphenyl)propyl 2-(1-methylpiperidin-1-ium-1-yl)ethanoate

Systemtic Name: 3-(4-methylphenyl)propyl 2-(1-methylpiperidin-1-ium-1-yl)ethanoate Openeye Name: 3-(p-tolyl)propyl 2-(1-methylpiperidin-1-ium-1-yl)acetate CAS Name: 2-(1-methyl-1-piperidin-1-iumyl)acetic acid 3-(4-methylphenyl)propyl ester IUPAC Name: 3-(4-methylphenyl)propyl 2-(1-methylpiperidin-1-ium-1-yl)acetate Traditional Name: 2-(1-methylpiperidin-1-ium-1-yl)acetic acid 3-(p-tolyl)propyl ester Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCOC(=O)C[N+]2(CCCCC2)C

Isomeric SMILES

CC1=CC=C(C=C1)CCCOC(=O)C[N+]2(CCCCC2)C

InChI

InChI=1S/C18H28NO2/c1-16-8-10-17(11-9-16)7-6-14-21-18(20)15-19(2)12-4-3-5-13-19/h8-11H,3-7,12-15H2,1-2H3/q+1