4-[7-(methoxymethoxy)-3-methyl-4-(9-oxidanylnonyl)-2,4-dihydrochromen-3-yl]benzoic acid

Systemtic Name: 4-[7-(methoxymethoxy)-3-methyl-4-(9-oxidanylnonyl)-2,4-dihydrochromen-3-yl]benzoic acid Openeye Name: 4-[4-(9-hydroxynonyl)-7-(methoxymethoxy)-3-methyl-chroman-3-yl]benzoic acid CAS Name: 4-[4-(9-hydroxynonyl)-7-(methoxymethoxy)-3-methyl-3,4-dihydro-2H-1-benzopyran-3-yl]benzoic acid IUPAC Name: 4-[4-(9-hydroxynonyl)-7-(methoxymethoxy)-3-methyl-2,4-dihydrochromen-3-yl]benzoic acid Traditional Name: 4-[4-(9-hydroxynonyl)-7-(methoxymethoxy)-3-methyl-chroman-3-yl]benzoic acid Formula: C28H38O6 MolecularWeight: 470.59772

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C1CCCCCCCCCO)C=CC(=C2)OCOC)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1(COC2=C(C1CCCCCCCCCO)C=CC(=C2)OCOC)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C28H38O6/c1-28(22-13-11-21(12-14-22)27(30)31)19-33-26-18-23(34-20-32-2)15-16-24(26)25(28)10-8-6-4-3-5-7-9-17-29/h11-16,18,25,29H,3-10,17,19-20H2,1-2H3,(H,30,31)