[2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-bromanylbenzoate

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-bromanylbenzoate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C20H14BrN3O2 MolecularWeight: 408.24806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14BrN3O2/c1-13-6-11-19(26-20(25)14-7-9-15(21)10-8-14)18(12-13)24-22-16-4-2-3-5-17(16)23-24/h2-12H,1H3