[(E)-18-chloranyl-18-oxidanylidene-octadec-9-en-7-yl] ethanoate

Systemtic Name: [(E)-18-chloranyl-18-oxidanylidene-octadec-9-en-7-yl] ethanoate Openeye Name: [(E)-12-chloro-1-hexyl-12-oxo-dodec-3-enyl] acetate CAS Name: acetic acid [(E)-18-chloro-18-oxooctadec-9-en-7-yl] ester IUPAC Name: [(E)-18-chloro-18-oxooctadec-9-en-7-yl] acetate Traditional Name: acetic acid [(E)-12-chloro-1-hexyl-12-keto-dodec-3-enyl] ester Formula: C20H35ClO3 MolecularWeight: 358.9431

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)Cl)OC(=O)C

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)Cl)OC(=O)C

InChI

InChI=1S/C20H35ClO3/c1-3-4-5-12-15-19(24-18(2)22)16-13-10-8-6-7-9-11-14-17-20(21)23/h10,13,19H,3-9,11-12,14-17H2,1-2H3/b13-10+