octadecyl (E)-octadec-9-enoate

Systemtic Name: octadecyl (E)-octadec-9-enoate Openeye Name: octadecyl (E)-octadec-9-enoate CAS Name: (E)-9-octadecenoic acid octadecyl ester IUPAC Name: octadecyl (E)-octadec-9-enoate Traditional Name: (E)-octadec-9-enoic acid stearyl ester Formula: C36H70O2 MolecularWeight: 534.9398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C36H70O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20H,3-17,19,21-35H2,1-2H3/b20-18+