7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]naphthalene-2-carboxylic acid

Systemtic Name: 7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]naphthalene-2-carboxylic acid Openeye Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]naphthalene-2-carboxylic acid CAS Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-2-naphthalenecarboxylic acid IUPAC Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]naphthalene-2-carboxylic acid Traditional Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-naphthoic acid Formula: C25H26O7 MolecularWeight: 438.46974

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=CC3=C(C=CC(=C3)C(=O)O)C=C2)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=CC3=C(C=CC(=C3)C(=O)O)C=C2)O

InChI

InChI=1S/C25H26O7/c1-3-4-22-23(10-9-21(15(2)26)24(22)28)32-14-19(27)13-31-20-8-7-16-5-6-17(25(29)30)11-18(16)12-20/h5-12,19,27-28H,3-4,13-14H2,1-2H3,(H,29,30)