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

Systemtic Name: 2-[2-(benzotriazol-2-yl)-4-chloranyl-phenoxy]-2-(4-tert-butylphenyl)ethanoic acid Openeye Name: 2-[2-(benzotriazol-2-yl)-4-chloro-phenoxy]-2-(4-tert-butylphenyl)acetic acid CAS Name: 2-[2-(2-benzotriazolyl)-4-chlorophenoxy]-2-(4-tert-butylphenyl)acetic acid IUPAC Name: 2-[2-(benzotriazol-2-yl)-4-chlorophenoxy]-2-(4-tert-butylphenyl)acetic acid Traditional Name: 2-[2-(benzotriazol-2-yl)-4-chloro-phenoxy]-2-(4-tert-butylphenyl)acetic acid Formula: C24H22ClN3O3 MolecularWeight: 435.90278

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C24H22ClN3O3/c1-24(2,3)16-10-8-15(9-11-16)22(23(29)30)31-21-13-12-17(25)14-20(21)28-26-18-6-4-5-7-19(18)27-28/h4-14,22H,1-3H3,(H,29,30)