1-butoxypropyl (E)-12-oxidanyloctadec-9-enoate

Systemtic Name: 1-butoxypropyl (E)-12-oxidanyloctadec-9-enoate Openeye Name: 1-butoxypropyl (E)-12-hydroxyoctadec-9-enoate CAS Name: (E)-12-hydroxy-9-octadecenoic acid 1-butoxypropyl ester IUPAC Name: 1-butoxypropyl (E)-12-hydroxyoctadec-9-enoate Traditional Name: (E)-12-hydroxyoctadec-9-enoic acid 1-butoxypropyl ester Formula: C25H48O4 MolecularWeight: 412.64622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)OC(CC)OCCCC)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)OC(CC)OCCCC)O

InChI

InChI=1S/C25H48O4/c1-4-7-9-16-19-23(26)20-17-14-12-10-11-13-15-18-21-24(27)29-25(6-3)28-22-8-5-2/h14,17,23,25-26H,4-13,15-16,18-22H2,1-3H3/b17-14+