[(2S)-3-[(4-methoxyphenyl)methoxy]-2-(12-prop-2-enoyloxydodecanoyloxy)propyl] hexadecanoate

Systemtic Name: [(2S)-3-[(4-methoxyphenyl)methoxy]-2-(12-prop-2-enoyloxydodecanoyloxy)propyl] hexadecanoate Openeye Name: [(2S)-3-[(4-methoxyphenyl)methoxy]-2-(12-prop-2-enoyloxydodecanoyloxy)propyl] hexadecanoate CAS Name: hexadecanoic acid [(2S)-3-[(4-methoxyphenyl)methoxy]-2-[1-oxo-12-(1-oxoprop-2-enoxy)dodecoxy]propyl] ester IUPAC Name: [(2S)-3-[(4-methoxyphenyl)methoxy]-2-(12-prop-2-enoyloxydodecanoyloxy)propyl] hexadecanoate Traditional Name: palmitic acid [(2S)-2-(12-acryloyloxydodecanoyloxy)-3-p-anisyloxy-propyl] ester Formula: C42H70O8 MolecularWeight: 703.0004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COCC1=CC=C(C=C1)OC)OC(=O)CCCCCCCCCCCOC(=O)C=C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COCC1=CC=C(C=C1)OC)OC(=O)CCCCCCCCCCCOC(=O)C=C

InChI

InChI=1S/C42H70O8/c1-4-6-7-8-9-10-11-12-13-15-18-21-24-27-41(44)49-36-39(35-47-34-37-29-31-38(46-3)32-30-37)50-42(45)28-25-22-19-16-14-17-20-23-26-33-48-40(43)5-2/h5,29-32,39H,2,4,6-28,33-36H2,1,3H3/t39-/m0/s1