4-bromanyl-2-(3-methoxyphenyl)benzotriazol-5-amine

Systemtic Name: 4-bromanyl-2-(3-methoxyphenyl)benzotriazol-5-amine Openeye Name: 4-bromo-2-(3-methoxyphenyl)benzotriazol-5-amine CAS Name: 4-bromo-2-(3-methoxyphenyl)-5-benzotriazolamine IUPAC Name: 4-bromo-2-(3-methoxyphenyl)benzotriazol-5-amine Traditional Name: [4-bromo-2-(3-methoxyphenyl)benzotriazol-5-yl]amine Formula: C13H11BrN4O MolecularWeight: 319.15664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2N=C3C=CC(=C(C3=N2)Br)N

Isomeric SMILES

COC1=CC=CC(=C1)N2N=C3C=CC(=C(C3=N2)Br)N

InChI

InChI=1S/C13H11BrN4O/c1-19-9-4-2-3-8(7-9)18-16-11-6-5-10(15)12(14)13(11)17-18/h2-7H,15H2,1H3