2-[2-(benzotriazol-2-yl)-4-chloranyl-phenoxy]-2-(4-tert-butylphenyl)propanoic acid

Systemtic Name: 2-[2-(benzotriazol-2-yl)-4-chloranyl-phenoxy]-2-(4-tert-butylphenyl)propanoic acid Openeye Name: 2-[2-(benzotriazol-2-yl)-4-chloro-phenoxy]-2-(4-tert-butylphenyl)propanoic acid CAS Name: 2-[2-(2-benzotriazolyl)-4-chlorophenoxy]-2-(4-tert-butylphenyl)propanoic acid IUPAC Name: 2-[2-(benzotriazol-2-yl)-4-chlorophenoxy]-2-(4-tert-butylphenyl)propanoic acid Traditional Name: 2-[2-(benzotriazol-2-yl)-4-chloro-phenoxy]-2-(4-tert-butylphenyl)propionic acid Formula: C25H24ClN3O3 MolecularWeight: 449.92936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C)(C(=O)O)OC2=C(C=C(C=C2)Cl)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(C)(C(=O)O)OC2=C(C=C(C=C2)Cl)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C25H24ClN3O3/c1-24(2,3)16-9-11-17(12-10-16)25(4,23(30)31)32-22-14-13-18(26)15-21(22)29-27-19-7-5-6-8-20(19)28-29/h5-15H,1-4H3,(H,30,31)