phenyl (E)-icos-3-enoate

Systemtic Name: phenyl (E)-icos-3-enoate Openeye Name: phenyl (E)-icos-3-enoate CAS Name: (E)-3-eicosenoic acid phenyl ester IUPAC Name: phenyl (E)-icos-3-enoate Traditional Name: (E)-eicos-3-enoic acid phenyl ester Formula: C26H42O2 MolecularWeight: 386.61048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC=CCC(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCC/C=C/CC(=O)OC1=CC=CC=C1

InChI

InChI=1S/C26H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-26(27)28-25-22-19-18-20-23-25/h17-23H,2-16,24H2,1H3/b21-17+