2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(2-chlorophenyl)ethanoic acid

Systemtic Name: 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(2-chlorophenyl)ethanoic acid Openeye Name: 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(2-chlorophenyl)acetic acid CAS Name: 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyanophenoxy]-2-(2-chlorophenyl)acetic acid IUPAC Name: 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyanophenoxy]-2-(2-chlorophenyl)acetic acid Traditional Name: 2-[5-(1,3-benzoxazol-6-ylmethoxy)-2-cyano-phenoxy]-2-(2-chlorophenyl)acetic acid Formula: C23H15ClN2O5 MolecularWeight: 434.8286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(=O)O)OC2=C(C=CC(=C2)OCC3=CC4=C(C=C3)N=CO4)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(C(=O)O)OC2=C(C=CC(=C2)OCC3=CC4=C(C=C3)N=CO4)C#N)Cl

InChI

InChI=1S/C23H15ClN2O5/c24-18-4-2-1-3-17(18)22(23(27)28)31-20-10-16(7-6-15(20)11-25)29-12-14-5-8-19-21(9-14)30-13-26-19/h1-10,13,22H,12H2,(H,27,28)