4,4-bis(benzotriazol-1-yl)butan-2-one

Systemtic Name: 4,4-bis(benzotriazol-1-yl)butan-2-one Openeye Name: 4,4-bis(benzotriazol-1-yl)butan-2-one CAS Name: 4,4-bis(1-benzotriazolyl)-2-butanone IUPAC Name: 4,4-bis(benzotriazol-1-yl)butan-2-one Traditional Name: 4,4-bis(benzotriazol-1-yl)butan-2-one Formula: C16H14N6O MolecularWeight: 306.32196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(N1C2=CC=CC=C2N=N1)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(=O)CC(N1C2=CC=CC=C2N=N1)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H14N6O/c1-11(23)10-16(21-14-8-4-2-6-12(14)17-19-21)22-15-9-5-3-7-13(15)18-20-22/h2-9,16H,10H2,1H3