1-(4,4-dimethylpent-2-ynyl)benzotriazole

Systemtic Name: 1-(4,4-dimethylpent-2-ynyl)benzotriazole Openeye Name: 1-(4,4-dimethylpent-2-ynyl)benzotriazole CAS Name: 1-(4,4-dimethylpent-2-ynyl)benzotriazole IUPAC Name: 1-(4,4-dimethylpent-2-ynyl)benzotriazole Traditional Name: 1-(4,4-dimethylpent-2-ynyl)benzotriazole Formula: C13H15N3 MolecularWeight: 213.2783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CCN1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C)(C)C#CCN1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H15N3/c1-13(2,3)9-6-10-16-12-8-5-4-7-11(12)14-15-16/h4-5,7-8H,10H2,1-3H3