2-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]ethanoate

Systemtic Name: 2-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]ethanoate Openeye Name: 2-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]acetate CAS Name: 2-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]acetate IUPAC Name: 2-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]acetate Traditional Name: 2-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]acetate Formula: C15H21NO2 MolecularWeight: 247.33274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CC(=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CC(=O)[O-]

InChI

InChI=1S/C15H21NO2/c1-12-6-8-16(9-7-12)11-14-4-2-13(3-5-14)10-15(17)18/h2-5,12H,6-11H2,1H3,(H,17,18)