[(Z)-2-[(E)-3-(4-methoxyphenyl)prop-2-enoxy]carbonylbut-2-enyl] hexadecanoate

Systemtic Name: [(Z)-2-[(E)-3-(4-methoxyphenyl)prop-2-enoxy]carbonylbut-2-enyl] hexadecanoate Openeye Name: [(Z)-2-[(E)-3-(4-methoxyphenyl)allyloxy]carbonylbut-2-enyl] hexadecanoate CAS Name: hexadecanoic acid [(Z)-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoxy]-oxomethyl]but-2-enyl] ester IUPAC Name: [(Z)-2-[(E)-3-(4-methoxyphenyl)prop-2-enoxy]carbonylbut-2-enyl] hexadecanoate Traditional Name: palmitic acid [(Z)-2-[(E)-3-(4-methoxyphenyl)allyloxy]carbonylbut-2-enyl] ester Formula: C31H48O5 MolecularWeight: 500.70982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(=CC)C(=O)OCC=CC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC/C(=C/C)/C(=O)OC/C=C/C1=CC=C(C=C1)OC

InChI

InChI=1S/C31H48O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-30(32)36-26-28(5-2)31(33)35-25-18-19-27-21-23-29(34-3)24-22-27/h5,18-19,21-24H,4,6-17,20,25-26H2,1-3H3/b19-18+,28-5-