2-[2-[(4-bromophenyl)-oxidanyl-methyl]-1,3-benzoxazol-5-yl]propanoic acid

Systemtic Name: 2-[2-[(4-bromophenyl)-oxidanyl-methyl]-1,3-benzoxazol-5-yl]propanoic acid Openeye Name: 2-[2-[(4-bromophenyl)-hydroxy-methyl]-1,3-benzoxazol-5-yl]propanoic acid CAS Name: 2-[2-[(4-bromophenyl)-hydroxymethyl]-1,3-benzoxazol-5-yl]propanoic acid IUPAC Name: 2-[2-[(4-bromophenyl)-hydroxymethyl]-1,3-benzoxazol-5-yl]propanoic acid Traditional Name: 2-[2-[(4-bromophenyl)-hydroxy-methyl]-1,3-benzoxazol-5-yl]propionic acid Formula: C17H14BrNO4 MolecularWeight: 376.20136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OC(=N2)C(C3=CC=C(C=C3)Br)O)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)OC(=N2)C(C3=CC=C(C=C3)Br)O)C(=O)O

InChI

InChI=1S/C17H14BrNO4/c1-9(17(21)22)11-4-7-14-13(8-11)19-16(23-14)15(20)10-2-5-12(18)6-3-10/h2-9,15,20H,1H3,(H,21,22)