3-bromanyl-6-oxidanyl-2-pentadecyl-benzoic acid

Systemtic Name: 3-bromanyl-6-oxidanyl-2-pentadecyl-benzoic acid Openeye Name: 3-bromo-6-hydroxy-2-pentadecyl-benzoic acid CAS Name: 3-bromo-6-hydroxy-2-pentadecylbenzoic acid IUPAC Name: 3-bromo-6-hydroxy-2-pentadecylbenzoic acid Traditional Name: 3-bromo-6-hydroxy-2-pentadecyl-benzoic acid Formula: C22H35BrO3 MolecularWeight: 427.4155

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C=CC(=C1C(=O)O)O)Br

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C=CC(=C1C(=O)O)O)Br

InChI

InChI=1S/C22H35BrO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-19(23)16-17-20(24)21(18)22(25)26/h16-17,24H,2-15H2,1H3,(H,25,26)