3-[4-[2-(3-hydroxyphenyl)-3-methyl-6-oxidanyl-naphthalen-1-yl]oxyphenyl]propanoic acid

Systemtic Name: 3-[4-[2-(3-hydroxyphenyl)-3-methyl-6-oxidanyl-naphthalen-1-yl]oxyphenyl]propanoic acid Openeye Name: 3-[4-[[6-hydroxy-2-(3-hydroxyphenyl)-3-methyl-1-naphthyl]oxy]phenyl]propanoic acid CAS Name: 3-[4-[[6-hydroxy-2-(3-hydroxyphenyl)-3-methyl-1-naphthalenyl]oxy]phenyl]propanoic acid IUPAC Name: 3-[4-[6-hydroxy-2-(3-hydroxyphenyl)-3-methylnaphthalen-1-yl]oxyphenyl]propanoic acid Traditional Name: 3-[4-[6-hydroxy-2-(3-hydroxyphenyl)-3-methyl-1-naphthoxy]phenyl]propionic acid Formula: C26H22O5 MolecularWeight: 414.44988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=CC2=C1)O)OC3=CC=C(C=C3)CCC(=O)O)C4=CC(=CC=C4)O

Isomeric SMILES

CC1=C(C(=C2C=CC(=CC2=C1)O)OC3=CC=C(C=C3)CCC(=O)O)C4=CC(=CC=C4)O

InChI

InChI=1S/C26H22O5/c1-16-13-19-15-21(28)8-11-23(19)26(25(16)18-3-2-4-20(27)14-18)31-22-9-5-17(6-10-22)7-12-24(29)30/h2-6,8-11,13-15,27-28H,7,12H2,1H3,(H,29,30)