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

Systemtic Name: 2-ethylhexyl (E)-12-oxidanyloctadec-9-enoate Openeye Name: 2-ethylhexyl (E)-12-hydroxyoctadec-9-enoate CAS Name: (E)-12-hydroxy-9-octadecenoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl (E)-12-hydroxyoctadec-9-enoate Traditional Name: (E)-12-hydroxyoctadec-9-enoic acid 2-ethylhexyl ester Formula: C26H50O3 MolecularWeight: 410.6734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)OCC(CC)CCCC)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)OCC(CC)CCCC)O

InChI

InChI=1S/C26H50O3/c1-4-7-9-16-20-25(27)21-17-14-12-10-11-13-15-18-22-26(28)29-23-24(6-3)19-8-5-2/h14,17,24-25,27H,4-13,15-16,18-23H2,1-3H3/b17-14+