8-ethanoyl-13-(3-ethylphenoxy)-12-oxidanyl-tridecanoic acid

Systemtic Name: 8-ethanoyl-13-(3-ethylphenoxy)-12-oxidanyl-tridecanoic acid Openeye Name: 8-acetyl-13-(3-ethylphenoxy)-12-hydroxy-tridecanoic acid CAS Name: 8-acetyl-13-(3-ethylphenoxy)-12-hydroxytridecanoic acid IUPAC Name: 8-acetyl-13-(3-ethylphenoxy)-12-hydroxytridecanoic acid Traditional Name: 8-acetyl-13-(3-ethylphenoxy)-12-hydroxy-tridecanoic acid Formula: C23H36O5 MolecularWeight: 392.52894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36O5/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/h8,10,14,16,20-21,25H,3-7,9,11-13,15,17H2,1-2H3,(H,26,27)