(2Z)-2-(1-tert-butyl-2H-1,2,3,4-tetrazol-5-ylidene)-1-phenyl-ethanone

Systemtic Name: (2Z)-2-(1-tert-butyl-2H-1,2,3,4-tetrazol-5-ylidene)-1-phenyl-ethanone Openeye Name: (2Z)-2-(1-tert-butyl-2H-tetrazol-5-ylidene)-1-phenyl-ethanone CAS Name: (2Z)-2-(1-tert-butyl-2H-tetrazol-5-ylidene)-1-phenylethanone IUPAC Name: (2Z)-2-(1-tert-butyl-2H-tetrazol-5-ylidene)-1-phenylethanone Traditional Name: (2Z)-2-(1-tert-butyl-2H-tetrazol-5-ylidene)-1-phenyl-ethanone Formula: C13H16N4O MolecularWeight: 244.29234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=CC(=O)C2=CC=CC=C2)N=NN1

Isomeric SMILES

CC(C)(C)N1/C(=C/C(=O)C2=CC=CC=C2)/N=NN1

InChI

InChI=1S/C13H16N4O/c1-13(2,3)17-12(14-15-16-17)9-11(18)10-7-5-4-6-8-10/h4-9H,1-3H3,(H,14,16)/b12-9+