[2-propanoyloxy-4-[2-(1,2,6-trimethylpiperidin-1-ium-1-yl)ethyl]phenyl] propanoate

Systemtic Name: [2-propanoyloxy-4-[2-(1,2,6-trimethylpiperidin-1-ium-1-yl)ethyl]phenyl] propanoate Openeye Name: [2-propanoyloxy-4-[2-(1,2,6-trimethylpiperidin-1-ium-1-yl)ethyl]phenyl] propanoate CAS Name: propanoic acid [2-(1-oxopropoxy)-4-[2-(1,2,6-trimethyl-1-piperidin-1-iumyl)ethyl]phenyl] ester IUPAC Name: [2-propanoyloxy-4-[2-(1,2,6-trimethylpiperidin-1-ium-1-yl)ethyl]phenyl] propanoate Traditional Name: propionic acid [2-propionyloxy-4-[2-(1,2,6-trimethylpiperidin-1-ium-1-yl)ethyl]phenyl] ester Formula: C22H34NO4+ MolecularWeight: 376.50966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C=C(C=C1)CC[N+]2(C(CCCC2C)C)C)OC(=O)CC

Isomeric SMILES

CCC(=O)OC1=C(C=C(C=C1)CC[N+]2(C(CCCC2C)C)C)OC(=O)CC

InChI

InChI=1S/C22H34NO4/c1-6-21(24)26-19-12-11-18(15-20(19)27-22(25)7-2)13-14-23(5)16(3)9-8-10-17(23)4/h11-12,15-17H,6-10,13-14H2,1-5H3/q+1