4-[4-(12-bromanyldodecanoyloxy)phenyl]carbonyloxybenzoic acid

Systemtic Name: 4-[4-(12-bromanyldodecanoyloxy)phenyl]carbonyloxybenzoic acid Openeye Name: 4-[4-(12-bromododecanoyloxy)benzoyl]oxybenzoic acid CAS Name: 4-[[4-(12-bromo-1-oxododecoxy)phenyl]-oxomethoxy]benzoic acid IUPAC Name: 4-[4-(12-bromododecanoyloxy)benzoyl]oxybenzoic acid Traditional Name: 4-[4-(12-bromododecanoyloxy)benzoyl]oxybenzoic acid Formula: C26H31BrO6 MolecularWeight: 519.42474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)OC(=O)C2=CC=C(C=C2)OC(=O)CCCCCCCCCCCBr

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)OC(=O)C2=CC=C(C=C2)OC(=O)CCCCCCCCCCCBr

InChI

InChI=1S/C26H31BrO6/c27-19-9-7-5-3-1-2-4-6-8-10-24(28)32-22-17-13-21(14-18-22)26(31)33-23-15-11-20(12-16-23)25(29)30/h11-18H,1-10,19H2,(H,29,30)