8-oxidanyl-9-(4-pentoxyphenoxy)non-5-ynoic acid

Systemtic Name: 8-oxidanyl-9-(4-pentoxyphenoxy)non-5-ynoic acid Openeye Name: 8-hydroxy-9-(4-pentoxyphenoxy)non-5-ynoic acid CAS Name: 8-hydroxy-9-(4-pentoxyphenoxy)-5-nonynoic acid IUPAC Name: 8-hydroxy-9-(4-pentoxyphenoxy)non-5-ynoic acid Traditional Name: 9-(4-amoxyphenoxy)-8-hydroxy-non-5-ynoic acid Formula: C20H28O5 MolecularWeight: 348.43332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)OCC(CC#CCCCC(=O)O)O

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)OCC(CC#CCCCC(=O)O)O

InChI

InChI=1S/C20H28O5/c1-2-3-8-15-24-18-11-13-19(14-12-18)25-16-17(21)9-6-4-5-7-10-20(22)23/h11-14,17,21H,2-3,5,7-10,15-16H2,1H3,(H,22,23)