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3-(12-bromanyldodecoxy)-2-(phenylcarbonyloxy)benzoic acid

3-(12-bromanyldodecoxy)-2-(phenylcarbonyloxy)benzoic acid

Systemtic Name:3-(12-bromanyldodecoxy)-2-(phenylcarbonyloxy)benzoic acid
Openeye Name:2-benzoyloxy-3-(12-bromododecoxy)benzoic acid
CAS Name:2-benzoyloxy-3-(12-bromododecoxy)benzoic acid
IUPAC Name:2-benzoyloxy-3-(12-bromododecoxy)benzoic acid
Traditional Name:2-benzoyloxy-3-(12-bromododecoxy)benzoic acid
Formula: C26H33BrO5
MolecularWeight: 505.44122
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C(C=CC=C2OCCCCCCCCCCCCBr)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C(C=CC=C2OCCCCCCCCCCCCBr)C(=O)O


InChI

InChI=1S/C26H33BrO5/c27-19-12-7-5-3-1-2-4-6-8-13-20-31-23-18-14-17-22(25(28)29)24(23)32-26(30)21-15-10-9-11-16-21/h9-11,14-18H,1-8,12-13,19-20H2,(H,28,29)


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