2-[3-[2,3-bis(oxidanyl)phenyl]propoxy]-5-octadecoxy-benzoic acid

Systemtic Name: 2-[3-[2,3-bis(oxidanyl)phenyl]propoxy]-5-octadecoxy-benzoic acid Openeye Name: 2-[3-(2,3-dihydroxyphenyl)propoxy]-5-octadecoxy-benzoic acid CAS Name: 2-[3-(2,3-dihydroxyphenyl)propoxy]-5-octadecoxybenzoic acid IUPAC Name: 2-[3-(2,3-dihydroxyphenyl)propoxy]-5-octadecoxybenzoic acid Traditional Name: 2-[3-(2,3-dihydroxyphenyl)propoxy]-5-stearyloxy-benzoic acid Formula: C34H52O6 MolecularWeight: 556.77308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCCCC2=C(C(=CC=C2)O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCCCC2=C(C(=CC=C2)O)O)C(=O)O

InChI

InChI=1S/C34H52O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-39-29-23-24-32(30(27-29)34(37)38)40-26-19-21-28-20-18-22-31(35)33(28)36/h18,20,22-24,27,35-36H,2-17,19,21,25-26H2,1H3,(H,37,38)