2-(4-bromophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol

Systemtic Name: 2-(4-bromophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol Openeye Name: 2-(4-bromophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol CAS Name: 2-(4-bromophenyl)-1,3-bis(1,2,4-triazol-1-yl)-2-propanol IUPAC Name: 2-(4-bromophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol Traditional Name: 2-(4-bromophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol Formula: C13H13BrN6O MolecularWeight: 349.18592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CN2C=NC=N2)(CN3C=NC=N3)O)Br

Isomeric SMILES

C1=CC(=CC=C1C(CN2C=NC=N2)(CN3C=NC=N3)O)Br

InChI

InChI=1S/C13H13BrN6O/c14-12-3-1-11(2-4-12)13(21,5-19-9-15-7-17-19)6-20-10-16-8-18-20/h1-4,7-10,21H,5-6H2