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

Systemtic Name: 3-(3-bromanyl-4-butoxy-5-methoxy-phenyl)propanoic acid Openeye Name: 3-(3-bromo-4-butoxy-5-methoxy-phenyl)propanoic acid CAS Name: 3-(3-bromo-4-butoxy-5-methoxyphenyl)propanoic acid IUPAC Name: 3-(3-bromo-4-butoxy-5-methoxyphenyl)propanoic acid Traditional Name: 3-(3-bromo-4-butoxy-5-methoxy-phenyl)propionic acid Formula: C14H19BrO4 MolecularWeight: 331.20226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrO4/c1-3-4-7-19-14-11(15)8-10(5-6-13(16)17)9-12(14)18-2/h8-9H,3-7H2,1-2H3,(H,16,17)