[2-[(E)-18-ethoxy-18-oxidanylidene-octadec-9-en-7-yl]oxy-2-oxidanylidene-ethyl] (E)-12-oxidanyloctadec-9-enoate

Systemtic Name: [2-[(E)-18-ethoxy-18-oxidanylidene-octadec-9-en-7-yl]oxy-2-oxidanylidene-ethyl] (E)-12-oxidanyloctadec-9-enoate Openeye Name: [2-[(E)-12-ethoxy-1-hexyl-12-oxo-dodec-3-enoxy]-2-oxo-ethyl] (E)-12-hydroxyoctadec-9-enoate CAS Name: (E)-12-hydroxy-9-octadecenoic acid [2-[(E)-18-ethoxy-18-oxooctadec-9-en-7-yl]oxy-2-oxoethyl] ester IUPAC Name: [2-[(E)-18-ethoxy-18-oxooctadec-9-en-7-yl]oxy-2-oxoethyl] (E)-12-hydroxyoctadec-9-enoate Traditional Name: (E)-12-hydroxyoctadec-9-enoic acid [2-[(E)-12-ethoxy-1-hexyl-12-keto-dodec-3-enoxy]-2-keto-ethyl] ester Formula: C40H72O7 MolecularWeight: 664.99548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)OCC(=O)OC(CCCCCC)CC=CCCCCCCCC(=O)OCC)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)OCC(=O)OC(CCCCCC)C/C=C/CCCCCCCC(=O)OCC)O

InChI

InChI=1S/C40H72O7/c1-4-7-9-23-29-36(41)30-24-19-15-11-13-18-22-28-34-39(43)46-35-40(44)47-37(31-25-10-8-5-2)32-26-20-16-12-14-17-21-27-33-38(42)45-6-3/h19-20,24,26,36-37,41H,4-18,21-23,25,27-35H2,1-3H3/b24-19+,26-20+