2-octyldodecyl (E)-12-oxidanyloctadec-9-enoate

Systemtic Name: 2-octyldodecyl (E)-12-oxidanyloctadec-9-enoate Openeye Name: 2-octyldodecyl (E)-12-hydroxyoctadec-9-enoate CAS Name: (E)-12-hydroxy-9-octadecenoic acid 2-octyldodecyl ester IUPAC Name: 2-octyldodecyl (E)-12-hydroxyoctadec-9-enoate Traditional Name: (E)-12-hydroxyoctadec-9-enoic acid 2-octyldodecyl ester Formula: C38H74O3 MolecularWeight: 578.99236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCC)COC(=O)CCCCCCCC=CCC(CCCCCC)O

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCC)COC(=O)CCCCCCC/C=C/CC(CCCCCC)O

InChI

InChI=1S/C38H74O3/c1-4-7-10-13-15-18-22-26-31-36(30-25-21-14-11-8-5-2)35-41-38(40)34-29-24-20-17-16-19-23-28-33-37(39)32-27-12-9-6-3/h23,28,36-37,39H,4-22,24-27,29-35H2,1-3H3/b28-23+