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

Systemtic Name: 2-[4-(3-bromanylpropoxy)-3-propanoyl-phenyl]ethanoic acid Openeye Name: 2-[4-(3-bromopropoxy)-3-propanoyl-phenyl]acetic acid CAS Name: 2-[4-(3-bromopropoxy)-3-(1-oxopropyl)phenyl]acetic acid IUPAC Name: 2-[4-(3-bromopropoxy)-3-propanoylphenyl]acetic acid Traditional Name: 2-[4-(3-bromopropoxy)-3-propionyl-phenyl]acetic acid Formula: C14H17BrO4 MolecularWeight: 329.18638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17BrO4/c1-2-12(16)11-8-10(9-14(17)18)4-5-13(11)19-7-3-6-15/h4-5,8H,2-3,6-7,9H2,1H3,(H,17,18)