2-ethyl-11-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]-2-pentyl-undecanoic acid

Systemtic Name: 2-ethyl-11-[3-(4-hydroxyphenyl)-3-methyl-7-oxidanyl-2,4-dihydrochromen-4-yl]-2-pentyl-undecanoic acid Openeye Name: 2-ethyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]-2-pentyl-undecanoic acid CAS Name: 2-ethyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-4-yl]-2-pentylundecanoic acid IUPAC Name: 2-ethyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-2,4-dihydrochromen-4-yl]-2-pentylundecanoic acid Traditional Name: 2-amyl-2-ethyl-11-[7-hydroxy-3-(4-hydroxyphenyl)-3-methyl-chroman-4-yl]undecanoic acid Formula: C34H50O5 MolecularWeight: 538.7578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)(CCCCCCCCCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

CCCCCC(CC)(CCCCCCCCCC1C2=C(C=C(C=C2)O)OCC1(C)C3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C34H50O5/c1-4-6-13-22-34(5-2,32(37)38)23-14-11-9-7-8-10-12-15-30-29-21-20-28(36)24-31(29)39-25-33(30,3)26-16-18-27(35)19-17-26/h16-21,24,30,35-36H,4-15,22-23,25H2,1-3H3,(H,37,38)