2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-2-(3-chlorophenyl)ethanoic acid

Systemtic Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-2-(3-chlorophenyl)ethanoic acid Openeye Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-2-(3-chlorophenyl)acetic acid CAS Name: 2-[2-(2-benzotriazolyl)-4-methylphenoxy]-2-(3-chlorophenyl)acetic acid IUPAC Name: 2-[2-(benzotriazol-2-yl)-4-methylphenoxy]-2-(3-chlorophenyl)acetic acid Traditional Name: 2-[2-(benzotriazol-2-yl)-4-methyl-phenoxy]-2-(3-chlorophenyl)acetic acid Formula: C21H16ClN3O3 MolecularWeight: 393.82304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C2=CC(=CC=C2)Cl)C(=O)O)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC(=C(C=C1)OC(C2=CC(=CC=C2)Cl)C(=O)O)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C21H16ClN3O3/c1-13-9-10-19(28-20(21(26)27)14-5-4-6-15(22)12-14)18(11-13)25-23-16-7-2-3-8-17(16)24-25/h2-12,20H,1H3,(H,26,27)