[(E)-1,2-bis(oxidanyl)nonadec-4-en-3-yl] (E)-hexadec-9-enoate

Systemtic Name: [(E)-1,2-bis(oxidanyl)nonadec-4-en-3-yl] (E)-hexadec-9-enoate Openeye Name: [(E)-1-(1,2-dihydroxyethyl)heptadec-2-enyl] (E)-hexadec-9-enoate CAS Name: (E)-9-hexadecenoic acid [(E)-1,2-dihydroxynonadec-4-en-3-yl] ester IUPAC Name: [(E)-1,2-dihydroxynonadec-4-en-3-yl] (E)-hexadec-9-enoate Traditional Name: (E)-hexadec-9-enoic acid [(E)-1-(1,2-dihydroxyethyl)heptadec-2-enyl] ester Formula: C35H66O4 MolecularWeight: 550.89614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=CC(C(CO)O)OC(=O)CCCCCCCC=CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/C(C(CO)O)OC(=O)CCCCCCC/C=C/CCCCCC

InChI

InChI=1S/C35H66O4/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-34(33(37)32-36)39-35(38)31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h14,16,28,30,33-34,36-37H,3-13,15,17-27,29,31-32H2,1-2H3/b16-14+,30-28+