3-[3,5-bis(bromanyl)-4-(3-methylbutoxy)phenyl]propanoic acid

Systemtic Name: 3-[3,5-bis(bromanyl)-4-(3-methylbutoxy)phenyl]propanoic acid Openeye Name: 3-(3,5-dibromo-4-isopentyloxy-phenyl)propanoic acid CAS Name: 3-[3,5-dibromo-4-(3-methylbutoxy)phenyl]propanoic acid IUPAC Name: 3-[3,5-dibromo-4-(3-methylbutoxy)phenyl]propanoic acid Traditional Name: 3-(3,5-dibromo-4-isoamoxy-phenyl)propionic acid Formula: C14H18Br2O3 MolecularWeight: 394.09892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1Br)CCC(=O)O)Br

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1Br)CCC(=O)O)Br

InChI

InChI=1S/C14H18Br2O3/c1-9(2)5-6-19-14-11(15)7-10(8-12(14)16)3-4-13(17)18/h7-9H,3-6H2,1-2H3,(H,17,18)