3-(3-bromanyl-2-butoxy-5-chloranyl-phenyl)propanoic acid

Systemtic Name: 3-(3-bromanyl-2-butoxy-5-chloranyl-phenyl)propanoic acid Openeye Name: 3-(3-bromo-2-butoxy-5-chloro-phenyl)propanoic acid CAS Name: 3-(3-bromo-2-butoxy-5-chlorophenyl)propanoic acid IUPAC Name: 3-(3-bromo-2-butoxy-5-chlorophenyl)propanoic acid Traditional Name: 3-(3-bromo-2-butoxy-5-chloro-phenyl)propionic acid Formula: C13H16BrClO3 MolecularWeight: 335.62134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1CCC(=O)O)Cl)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1CCC(=O)O)Cl)Br

InChI

InChI=1S/C13H16BrClO3/c1-2-3-6-18-13-9(4-5-12(16)17)7-10(15)8-11(13)14/h7-8H,2-6H2,1H3,(H,16,17)