1-(benzotriazol-1-yl)-7,7-dimethyl-octan-1-one

Systemtic Name: 1-(benzotriazol-1-yl)-7,7-dimethyl-octan-1-one Openeye Name: 1-(benzotriazol-1-yl)-7,7-dimethyl-octan-1-one CAS Name: 1-(1-benzotriazolyl)-7,7-dimethyl-1-octanone IUPAC Name: 1-(benzotriazol-1-yl)-7,7-dimethyloctan-1-one Traditional Name: 1-(benzotriazol-1-yl)-7,7-dimethyl-octan-1-one Formula: C16H23N3O MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCC(=O)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)CCCCCC(=O)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C16H23N3O/c1-16(2,3)12-8-4-5-11-15(20)19-14-10-7-6-9-13(14)17-18-19/h6-7,9-10H,4-5,8,11-12H2,1-3H3