[3-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoxy]-2-oxidanyl-propyl] (E)-octadec-9-enoate

Systemtic Name: [3-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoxy]-2-oxidanyl-propyl] (E)-octadec-9-enoate Openeye Name: [2-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxy-phenyl)allyloxy]propyl] (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid [2-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoxy]propyl] ester IUPAC Name: [2-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoxy]propyl] (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid [2-hydroxy-3-[(E)-3-(4-hydroxy-3-methoxy-phenyl)allyloxy]propyl] ester Formula: C31H50O6 MolecularWeight: 518.7251

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OCC(COCC=CC1=CC(=C(C=C1)O)OC)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OCC(COC/C=C/C1=CC(=C(C=C1)O)OC)O

InChI

InChI=1S/C31H50O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-31(34)37-26-28(32)25-36-23-18-19-27-21-22-29(33)30(24-27)35-2/h10-11,18-19,21-22,24,28,32-33H,3-9,12-17,20,23,25-26H2,1-2H3/b11-10+,19-18+