octadecanoic acid; (E)-1-[(E)-octadec-9-enoxy]octadec-9-ene

Systemtic Name: octadecanoic acid; (E)-1-[(E)-octadec-9-enoxy]octadec-9-ene Openeye Name: (E)-1-[(E)-octadec-9-enoxy]octadec-9-ene; stearic acid CAS Name: octadecanoic acid; (E)-1-[(E)-octadec-9-enoxy]-9-octadecene IUPAC Name: octadecanoic acid; (E)-1-[(E)-octadec-9-enoxy]octadec-9-ene Traditional Name: (E)-1-[(E)-octadec-9-enoxy]octadec-9-ene; stearic acid Formula: C54H106O3 MolecularWeight: 803.41764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCC=CCCCCCCCCOCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCC/C=C/CCCCCCCCOCCCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C36H70O.C18H36O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h17-20H,3-16,21-36H2,1-2H3;2-17H2,1H3,(H,19,20)/b19-17+,20-18+;