3-(3-bromanyl-4-butoxy-5-ethoxy-phenyl)propanoic acid

Systemtic Name: 3-(3-bromanyl-4-butoxy-5-ethoxy-phenyl)propanoic acid Openeye Name: 3-(3-bromo-4-butoxy-5-ethoxy-phenyl)propanoic acid CAS Name: 3-(3-bromo-4-butoxy-5-ethoxyphenyl)propanoic acid IUPAC Name: 3-(3-bromo-4-butoxy-5-ethoxyphenyl)propanoic acid Traditional Name: 3-(3-bromo-4-butoxy-5-ethoxy-phenyl)propionic acid Formula: C15H21BrO4 MolecularWeight: 345.22884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Br)CCC(=O)O)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Br)CCC(=O)O)OCC

InChI

InChI=1S/C15H21BrO4/c1-3-5-8-20-15-12(16)9-11(6-7-14(17)18)10-13(15)19-4-2/h9-10H,3-8H2,1-2H3,(H,17,18)