4-[4-[3,4-bis(oxidanyl)-5-propan-2-yl-phenyl]butoxy]-2-oxidanyl-3-propyl-benzoic acid

Systemtic Name: 4-[4-[3,4-bis(oxidanyl)-5-propan-2-yl-phenyl]butoxy]-2-oxidanyl-3-propyl-benzoic acid Openeye Name: 4-[4-(3,4-dihydroxy-5-isopropyl-phenyl)butoxy]-2-hydroxy-3-propyl-benzoic acid CAS Name: 4-[4-(3,4-dihydroxy-5-propan-2-ylphenyl)butoxy]-2-hydroxy-3-propylbenzoic acid IUPAC Name: 4-[4-(3,4-dihydroxy-5-propan-2-ylphenyl)butoxy]-2-hydroxy-3-propylbenzoic acid Traditional Name: 4-[4-(3,4-dihydroxy-5-isopropyl-phenyl)butoxy]-2-hydroxy-3-propyl-benzoic acid Formula: C23H30O6 MolecularWeight: 402.4807

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCC2=CC(=C(C(=C2)O)O)C(C)C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)O)OCCCCC2=CC(=C(C(=C2)O)O)C(C)C

InChI

InChI=1S/C23H30O6/c1-4-7-16-20(10-9-17(21(16)25)23(27)28)29-11-6-5-8-15-12-18(14(2)3)22(26)19(24)13-15/h9-10,12-14,24-26H,4-8,11H2,1-3H3,(H,27,28)