13-methyltetradecyl (E)-12-oxidanyloctadec-9-enoate

Systemtic Name: 13-methyltetradecyl (E)-12-oxidanyloctadec-9-enoate Openeye Name: 13-methyltetradecyl (E)-12-hydroxyoctadec-9-enoate CAS Name: (E)-12-hydroxy-9-octadecenoic acid 13-methyltetradecyl ester IUPAC Name: 13-methyltetradecyl (E)-12-hydroxyoctadec-9-enoate Traditional Name: (E)-12-hydroxyoctadec-9-enoic acid 13-methyltetradecyl ester Formula: C33H64O3 MolecularWeight: 508.85946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)OCCCCCCCCCCCCC(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C33H64O3/c1-4-5-6-22-27-32(34)28-23-18-14-10-11-15-19-24-29-33(35)36-30-25-20-16-12-8-7-9-13-17-21-26-31(2)3/h18,23,31-32,34H,4-17,19-22,24-30H2,1-3H3/b23-18+