3-[7-[1-(4-ethanoyl-2-propyl-phenoxy)-3-oxidanyl-propoxy]naphthalen-2-yl]propanoic acid

Systemtic Name: 3-[7-[1-(4-ethanoyl-2-propyl-phenoxy)-3-oxidanyl-propoxy]naphthalen-2-yl]propanoic acid Openeye Name: 3-[7-[1-(4-acetyl-2-propyl-phenoxy)-3-hydroxy-propoxy]-2-naphthyl]propanoic acid CAS Name: 3-[7-[1-(4-acetyl-2-propylphenoxy)-3-hydroxypropoxy]-2-naphthalenyl]propanoic acid IUPAC Name: 3-[7-[1-(4-acetyl-2-propylphenoxy)-3-hydroxypropoxy]naphthalen-2-yl]propanoic acid Traditional Name: 3-[7-[1-(4-acetyl-2-propyl-phenoxy)-3-hydroxy-propoxy]-2-naphthyl]propionic acid Formula: C27H30O6 MolecularWeight: 450.5235

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)C)OC(CCO)OC2=CC3=C(C=CC(=C3)CCC(=O)O)C=C2

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)C)OC(CCO)OC2=CC3=C(C=CC(=C3)CCC(=O)O)C=C2

InChI

InChI=1S/C27H30O6/c1-3-4-22-16-21(18(2)29)9-11-25(22)33-27(13-14-28)32-24-10-8-20-7-5-19(6-12-26(30)31)15-23(20)17-24/h5,7-11,15-17,27-28H,3-4,6,12-14H2,1-2H3,(H,30,31)