[2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl] hexadecanoate

Systemtic Name: [2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl] hexadecanoate Openeye Name: [2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)-4-piperidyl] hexadecanoate CAS Name: hexadecanoic acid [2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)-4-piperidinyl] ester IUPAC Name: [2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)piperidin-4-yl] hexadecanoate Traditional Name: palmitic acid [2,6-diethyl-2,3,6-trimethyl-1-(1-phenylethoxy)-4-piperidyl] ester Formula: C36H63NO3 MolecularWeight: 557.89032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC1CC(N(C(C1C)(C)CC)OC(C)C2=CC=CC=C2)(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC1CC(N(C(C1C)(C)CC)OC(C)C2=CC=CC=C2)(C)CC

InChI

InChI=1S/C36H63NO3/c1-8-11-12-13-14-15-16-17-18-19-20-21-25-28-34(38)39-33-29-35(6,9-2)37(36(7,10-3)30(33)4)40-31(5)32-26-23-22-24-27-32/h22-24,26-27,30-31,33H,8-21,25,28-29H2,1-7H3