(1,1,3,3-tetramethyl-4-phenyl-piperidin-1-ium-4-yl) propanoate

Systemtic Name: (1,1,3,3-tetramethyl-4-phenyl-piperidin-1-ium-4-yl) propanoate Openeye Name: (1,1,3,3-tetramethyl-4-phenyl-piperidin-1-ium-4-yl) propanoate CAS Name: propanoic acid (1,1,3,3-tetramethyl-4-phenyl-4-piperidin-1-iumyl) ester IUPAC Name: (1,1,3,3-tetramethyl-4-phenylpiperidin-1-ium-4-yl) propanoate Traditional Name: propionic acid (1,1,3,3-tetramethyl-4-phenyl-piperidin-1-ium-4-yl) ester Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28NO2/c1-6-16(20)21-18(15-10-8-7-9-11-15)12-13-19(4,5)14-17(18,2)3/h7-11H,6,12-14H2,1-5H3/q+1