1-(3,3-dimethylbutyl)benzotriazole-5-carboxylic acid

Systemtic Name: 1-(3,3-dimethylbutyl)benzotriazole-5-carboxylic acid Openeye Name: 1-(3,3-dimethylbutyl)benzotriazole-5-carboxylic acid CAS Name: 1-(3,3-dimethylbutyl)-5-benzotriazolecarboxylic acid IUPAC Name: 1-(3,3-dimethylbutyl)benzotriazole-5-carboxylic acid Traditional Name: 1-(3,3-dimethylbutyl)benzotriazole-5-carboxylic acid Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCN1C2=C(C=C(C=C2)C(=O)O)N=N1

Isomeric SMILES

CC(C)(C)CCN1C2=C(C=C(C=C2)C(=O)O)N=N1

InChI

InChI=1S/C13H17N3O2/c1-13(2,3)6-7-16-11-5-4-9(12(17)18)8-10(11)14-15-16/h4-5,8H,6-7H2,1-3H3,(H,17,18)