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

Systemtic Name: 3-bromanyl-5-methoxy-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]benzoic acid Openeye Name: 3-bromo-5-methoxy-4-[(3-methylisoxazol-5-yl)methoxy]benzoic acid CAS Name: 3-bromo-5-methoxy-4-[(3-methyl-5-isoxazolyl)methoxy]benzoic acid IUPAC Name: 3-bromo-5-methoxy-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]benzoic acid Traditional Name: 3-bromo-5-methoxy-4-[(3-methylisoxazol-5-yl)methoxy]benzoic acid Formula: C13H12BrNO5 MolecularWeight: 342.14208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)COC2=C(C=C(C=C2Br)C(=O)O)OC

Isomeric SMILES

CC1=NOC(=C1)COC2=C(C=C(C=C2Br)C(=O)O)OC

InChI

InChI=1S/C13H12BrNO5/c1-7-3-9(20-15-7)6-19-12-10(14)4-8(13(16)17)5-11(12)18-2/h3-5H,6H2,1-2H3,(H,16,17)