[3-[2-(ethylamino)-1-oxidanyl-ethyl]phenyl] octadecanoate

Systemtic Name: [3-[2-(ethylamino)-1-oxidanyl-ethyl]phenyl] octadecanoate Openeye Name: [3-[2-(ethylamino)-1-hydroxy-ethyl]phenyl] octadecanoate CAS Name: octadecanoic acid [3-[2-(ethylamino)-1-hydroxyethyl]phenyl] ester IUPAC Name: [3-[2-(ethylamino)-1-hydroxyethyl]phenyl] octadecanoate Traditional Name: stearic acid [3-[2-(ethylamino)-1-hydroxy-ethyl]phenyl] ester Formula: C28H49NO3 MolecularWeight: 447.69356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC(=C1)C(CNCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=CC(=C1)C(CNCC)O

InChI

InChI=1S/C28H49NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28(31)32-26-21-19-20-25(23-26)27(30)24-29-4-2/h19-21,23,27,29-30H,3-18,22,24H2,1-2H3