2-[4-(benzo[e][1,3]benzoxazol-2-ylmethoxy)-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(benzo[e][1,3]benzoxazol-2-ylmethoxy)-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-(benzo[e][1,3]benzoxazol-2-ylmethoxy)-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-(2-benzo[e][1,3]benzoxazolylmethoxy)-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-(benzo[e][1,3]benzoxazol-2-ylmethoxy)-2-methylphenoxy]acetic acid Traditional Name: 2-[4-(benzo[e][1,3]benzoxazol-2-ylmethoxy)-2-methyl-phenoxy]acetic acid Formula: C21H17NO5 MolecularWeight: 363.36338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC3=C(O2)C=CC4=CC=CC=C43)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC3=C(O2)C=CC4=CC=CC=C43)OCC(=O)O

InChI

InChI=1S/C21H17NO5/c1-13-10-15(7-9-17(13)26-12-20(23)24)25-11-19-22-21-16-5-3-2-4-14(16)6-8-18(21)27-19/h2-10H,11-12H2,1H3,(H,23,24)