3-butoxypropyl (E)-2-oxidanyloctadec-9-enoate

Systemtic Name: 3-butoxypropyl (E)-2-oxidanyloctadec-9-enoate Openeye Name: 3-butoxypropyl (E)-2-hydroxyoctadec-9-enoate CAS Name: (E)-2-hydroxy-9-octadecenoic acid 3-butoxypropyl ester IUPAC Name: 3-butoxypropyl (E)-2-hydroxyoctadec-9-enoate Traditional Name: (E)-2-hydroxyoctadec-9-enoic acid 3-butoxypropyl ester Formula: C25H48O4 MolecularWeight: 412.64622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCC(C(=O)OCCCOCCCC)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCC(C(=O)OCCCOCCCC)O

InChI

InChI=1S/C25H48O4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-24(26)25(27)29-23-19-22-28-21-6-4-2/h12-13,24,26H,3-11,14-23H2,1-2H3/b13-12+