(E)-3-[3-(3-oxidanylpropoxy)propoxycarbonyl]pentadec-4-enoic acid

Systemtic Name: (E)-3-[3-(3-oxidanylpropoxy)propoxycarbonyl]pentadec-4-enoic acid Openeye Name: (E)-3-[3-(3-hydroxypropoxy)propoxycarbonyl]pentadec-4-enoic acid CAS Name: (E)-3-[3-(3-hydroxypropoxy)propoxy-oxomethyl]-4-pentadecenoic acid IUPAC Name: (E)-3-[3-(3-hydroxypropoxy)propoxycarbonyl]pentadec-4-enoic acid Traditional Name: (E)-3-[3-(3-hydroxypropoxy)propoxycarbonyl]pentadec-4-enoic acid Formula: C22H40O6 MolecularWeight: 400.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=CC(CC(=O)O)C(=O)OCCCOCCCO

Isomeric SMILES

CCCCCCCCCC/C=C/C(CC(=O)O)C(=O)OCCCOCCCO

InChI

InChI=1S/C22H40O6/c1-2-3-4-5-6-7-8-9-10-11-14-20(19-21(24)25)22(26)28-18-13-17-27-16-12-15-23/h11,14,20,23H,2-10,12-13,15-19H2,1H3,(H,24,25)/b14-11+