2-[2-(benzotriazol-2-yl)-4-methoxy-phenoxy]-2-(4-bromophenyl)ethanoic acid

Systemtic Name: 2-[2-(benzotriazol-2-yl)-4-methoxy-phenoxy]-2-(4-bromophenyl)ethanoic acid Openeye Name: 2-[2-(benzotriazol-2-yl)-4-methoxy-phenoxy]-2-(4-bromophenyl)acetic acid CAS Name: 2-[2-(2-benzotriazolyl)-4-methoxyphenoxy]-2-(4-bromophenyl)acetic acid IUPAC Name: 2-[2-(benzotriazol-2-yl)-4-methoxyphenoxy]-2-(4-bromophenyl)acetic acid Traditional Name: 2-[2-(benzotriazol-2-yl)-4-methoxy-phenoxy]-2-(4-bromophenyl)acetic acid Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC(C2=CC=C(C=C2)Br)C(=O)O)N3N=C4C=CC=CC4=N3

Isomeric SMILES

COC1=CC(=C(C=C1)OC(C2=CC=C(C=C2)Br)C(=O)O)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C21H16BrN3O4/c1-28-15-10-11-19(29-20(21(26)27)13-6-8-14(22)9-7-13)18(12-15)25-23-16-4-2-3-5-17(16)24-25/h2-12,20H,1H3,(H,26,27)