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11-bromanyl-11-[4-[4-(bromomethyl)phenyl]carbonylphenyl]undecanoic acid
11-bromanyl-11-[4-[4-(bromomethyl)phenyl]carbonylphenyl]undecanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC(=CC=C1CBr)C(=O)C2=CC=C(C=C2)C(CCCCCCCCCC(=O)O)Br
Isomeric SMILES
C1=CC(=CC=C1CBr)C(=O)C2=CC=C(C=C2)C(CCCCCCCCCC(=O)O)Br
InChI
InChI=1S/C25H30Br2O3/c26-18-19-10-12-21(13-11-19)25(30)22-16-14-20(15-17-22)23(27)8-6-4-2-1-3-5-7-9-24(28)29/h10-17,23H,1-9,18H2,(H,28,29)
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