2-ethyl-10-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]-2-pentyl-decanoic acid

Systemtic Name: 2-ethyl-10-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]-2-pentyl-decanoic acid Openeye Name: 2-ethyl-10-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]-2-pentyl-decanoic acid CAS Name: 2-ethyl-10-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pentyldecanoic acid IUPAC Name: 2-ethyl-10-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]-2-pentyldecanoic acid Traditional Name: 2-amyl-2-ethyl-10-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]capric acid Formula: C33H48O5 MolecularWeight: 524.73122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)(CCCCCCCCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

CCCCCC(CC)(CCCCCCCCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C33H48O5/c1-4-6-12-21-33(5-2,31(36)37)22-13-10-8-7-9-11-14-29-28-20-19-27(35)23-30(28)38-24-32(29,3)25-15-17-26(34)18-16-25/h15-20,23,29,34-35H,4-14,21-22,24H2,1-3H3,(H,36,37)