(4-tert-butylcyclohexyl) 2-(1-methylpiperidin-1-ium-1-yl)ethanoate

Systemtic Name: (4-tert-butylcyclohexyl) 2-(1-methylpiperidin-1-ium-1-yl)ethanoate Openeye Name: (4-tert-butylcyclohexyl) 2-(1-methylpiperidin-1-ium-1-yl)acetate CAS Name: 2-(1-methyl-1-piperidin-1-iumyl)acetic acid (4-tert-butylcyclohexyl) ester IUPAC Name: (4-tert-butylcyclohexyl) 2-(1-methylpiperidin-1-ium-1-yl)acetate Traditional Name: 2-(1-methylpiperidin-1-ium-1-yl)acetic acid (4-tert-butylcyclohexyl) ester Formula: C18H34NO2+ MolecularWeight: 296.46806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OC(=O)C[N+]2(CCCCC2)C

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OC(=O)C[N+]2(CCCCC2)C

InChI

InChI=1S/C18H34NO2/c1-18(2,3)15-8-10-16(11-9-15)21-17(20)14-19(4)12-6-5-7-13-19/h15-16H,5-14H2,1-4H3/q+1