1-(benzotriazol-1-yl)-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(benzotriazol-1-yl)-3,3-dimethyl-butan-2-one Openeye Name: 1-(benzotriazol-1-yl)-3,3-dimethyl-butan-2-one CAS Name: 1-(1-benzotriazolyl)-3,3-dimethyl-2-butanone IUPAC Name: 1-(benzotriazol-1-yl)-3,3-dimethylbutan-2-one Traditional Name: 1-(benzotriazol-1-yl)-3,3-dimethyl-butan-2-one Formula: C12H15N3O MolecularWeight: 217.267

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N=N1

InChI

InChI=1S/C12H15N3O/c1-12(2,3)11(16)8-15-10-7-5-4-6-9(10)13-14-15/h4-7H,8H2,1-3H3