3-[8-[3,4-bis(oxidanyl)phenyl]octoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 3-[8-[3,4-bis(oxidanyl)phenyl]octoxy]-2-oxidanyl-benzoic acid Openeye Name: 3-[8-(3,4-dihydroxyphenyl)octoxy]-2-hydroxy-benzoic acid CAS Name: 3-[8-(3,4-dihydroxyphenyl)octoxy]-2-hydroxybenzoic acid IUPAC Name: 3-[8-(3,4-dihydroxyphenyl)octoxy]-2-hydroxybenzoic acid Traditional Name: 3-[8-(3,4-dihydroxyphenyl)octoxy]-2-hydroxy-benzoic acid Formula: C21H26O6 MolecularWeight: 374.42754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OCCCCCCCCC2=CC(=C(C=C2)O)O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)OCCCCCCCCC2=CC(=C(C=C2)O)O)O)C(=O)O

InChI

InChI=1S/C21H26O6/c22-17-12-11-15(14-18(17)23)8-5-3-1-2-4-6-13-27-19-10-7-9-16(20(19)24)21(25)26/h7,9-12,14,22-24H,1-6,8,13H2,(H,25,26)