(E)-8-ethanoyl-13-(3-ethylphenoxy)-12-oxidanyl-tridec-5-enoic acid

Systemtic Name: (E)-8-ethanoyl-13-(3-ethylphenoxy)-12-oxidanyl-tridec-5-enoic acid Openeye Name: (E)-8-acetyl-13-(3-ethylphenoxy)-12-hydroxy-tridec-5-enoic acid CAS Name: (E)-8-acetyl-13-(3-ethylphenoxy)-12-hydroxy-5-tridecenoic acid IUPAC Name: (E)-8-acetyl-13-(3-ethylphenoxy)-12-hydroxytridec-5-enoic acid Traditional Name: (E)-8-acetyl-13-(3-ethylphenoxy)-12-hydroxy-tridec-5-enoic acid Formula: C23H34O5 MolecularWeight: 390.51306

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(CCCC(CC=CCCCC(=O)O)C(=O)C)O

Isomeric SMILES

CCC1=CC(=CC=C1)OCC(CCCC(C/C=C/CCCC(=O)O)C(=O)C)O

InChI

InChI=1S/C23H34O5/c1-3-19-10-8-14-22(16-19)28-17-21(25)13-9-12-20(18(2)24)11-6-4-5-7-15-23(26)27/h4,6,8,10,14,16,20-21,25H,3,5,7,9,11-13,15,17H2,1-2H3,(H,26,27)/b6-4+