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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O/c1-4-12(2,3)11(16)15-10-8-6-5-7-9(10)13-14-15/h5-8H,4H2,1-3H3