3-[3,5-bis(bromanyl)-4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]propanoic acid

Systemtic Name: 3-[3,5-bis(bromanyl)-4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]propanoic acid Openeye Name: 3-[3,5-dibromo-4-[(5-methylisoxazol-3-yl)methoxy]phenyl]propanoic acid CAS Name: 3-[3,5-dibromo-4-[(5-methyl-3-isoxazolyl)methoxy]phenyl]propanoic acid IUPAC Name: 3-[3,5-dibromo-4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]propanoic acid Traditional Name: 3-[3,5-dibromo-4-[(5-methylisoxazol-3-yl)methoxy]phenyl]propionic acid Formula: C14H13Br2NO4 MolecularWeight: 419.06532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC2=C(C=C(C=C2Br)CCC(=O)O)Br

Isomeric SMILES

CC1=CC(=NO1)COC2=C(C=C(C=C2Br)CCC(=O)O)Br

InChI

InChI=1S/C14H13Br2NO4/c1-8-4-10(17-21-8)7-20-14-11(15)5-9(6-12(14)16)2-3-13(18)19/h4-6H,2-3,7H2,1H3,(H,18,19)