1-(4-bromophenyl)-2-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(4-bromophenyl)-2-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(4-bromophenyl)-2-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(4-bromophenyl)-2-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(4-bromophenyl)-2-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(4-bromophenyl)-2-(1,2,4-triazol-1-yl)propan-1-one Formula: C11H10BrN3O MolecularWeight: 280.1206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Br)N2C=NC=N2

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Br)N2C=NC=N2

InChI

InChI=1S/C11H10BrN3O/c1-8(15-7-13-6-14-15)11(16)9-2-4-10(12)5-3-9/h2-8H,1H3