2-[4-(3-bromanylpropoxy)-3-ethyl-phenyl]ethanoic acid

Systemtic Name: 2-[4-(3-bromanylpropoxy)-3-ethyl-phenyl]ethanoic acid Openeye Name: 2-[4-(3-bromopropoxy)-3-ethyl-phenyl]acetic acid CAS Name: 2-[4-(3-bromopropoxy)-3-ethylphenyl]acetic acid IUPAC Name: 2-[4-(3-bromopropoxy)-3-ethylphenyl]acetic acid Traditional Name: 2-[4-(3-bromopropoxy)-3-ethyl-phenyl]acetic acid Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)CC(=O)O)OCCCBr

Isomeric SMILES

CCC1=C(C=CC(=C1)CC(=O)O)OCCCBr

InChI

InChI=1S/C13H17BrO3/c1-2-11-8-10(9-13(15)16)4-5-12(11)17-7-3-6-14/h4-5,8H,2-3,6-7,9H2,1H3,(H,15,16)