[1-(2-methyl-2-oxidanyl-propoxy)piperidin-4-yl] octadecanoate

Systemtic Name: [1-(2-methyl-2-oxidanyl-propoxy)piperidin-4-yl] octadecanoate Openeye Name: [1-(2-hydroxy-2-methyl-propoxy)-4-piperidyl] octadecanoate CAS Name: octadecanoic acid [1-(2-hydroxy-2-methylpropoxy)-4-piperidinyl] ester IUPAC Name: [1-(2-hydroxy-2-methylpropoxy)piperidin-4-yl] octadecanoate Traditional Name: stearic acid [1-(2-hydroxy-2-methyl-propoxy)-4-piperidyl] ester Formula: C27H53NO4 MolecularWeight: 455.71402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1CCN(CC1)OCC(C)(C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1CCN(CC1)OCC(C)(C)O

InChI

InChI=1S/C27H53NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)32-25-20-22-28(23-21-25)31-24-27(2,3)30/h25,30H,4-24H2,1-3H3