(1,1,2,5,5-pentamethyl-4-phenyl-piperidin-1-ium-4-yl) propanoate

Systemtic Name: (1,1,2,5,5-pentamethyl-4-phenyl-piperidin-1-ium-4-yl) propanoate Openeye Name: (1,1,2,5,5-pentamethyl-4-phenyl-piperidin-1-ium-4-yl) propanoate CAS Name: propanoic acid (1,1,2,5,5-pentamethyl-4-phenyl-4-piperidin-1-iumyl) ester IUPAC Name: (1,1,2,5,5-pentamethyl-4-phenylpiperidin-1-ium-4-yl) propanoate Traditional Name: propionic acid (1,1,2,5,5-pentamethyl-4-phenyl-piperidin-1-ium-4-yl) ester Formula: C19H30NO2+ MolecularWeight: 304.447

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(CC([N+](CC1(C)C)(C)C)C)C2=CC=CC=C2

Isomeric SMILES

CCC(=O)OC1(CC([N+](CC1(C)C)(C)C)C)C2=CC=CC=C2

InChI

InChI=1S/C19H30NO2/c1-7-17(21)22-19(16-11-9-8-10-12-16)13-15(2)20(5,6)14-18(19,3)4/h8-12,15H,7,13-14H2,1-6H3/q+1