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6-bromanyl-2-(phenylmethyl)hexanoic acid

6-bromanyl-2-(phenylmethyl)hexanoic acid

Systemtic Name:6-bromanyl-2-(phenylmethyl)hexanoic acid
Openeye Name:2-benzyl-6-bromo-hexanoic acid
CAS Name:6-bromo-2-(phenylmethyl)hexanoic acid
IUPAC Name:2-benzyl-6-bromohexanoic acid
Traditional Name:2-benzyl-6-bromo-hexanoic acid
Formula: C13H17BrO2
MolecularWeight: 285.17688
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCCCBr)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)CC(CCCCBr)C(=O)O


InChI

InChI=1S/C13H17BrO2/c14-9-5-4-8-12(13(15)16)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,15,16)


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