1-pentan-2-ylbenzotriazole-5-carboxylic acid

Systemtic Name: 1-pentan-2-ylbenzotriazole-5-carboxylic acid Openeye Name: 1-(1-methylbutyl)benzotriazole-5-carboxylic acid CAS Name: 1-pentan-2-yl-5-benzotriazolecarboxylic acid IUPAC Name: 1-pentan-2-ylbenzotriazole-5-carboxylic acid Traditional Name: 1-(1-methylbutyl)benzotriazole-5-carboxylic acid Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1C2=C(C=C(C=C2)C(=O)O)N=N1

Isomeric SMILES

CCCC(C)N1C2=C(C=C(C=C2)C(=O)O)N=N1

InChI

InChI=1S/C12H15N3O2/c1-3-4-8(2)15-11-6-5-9(12(16)17)7-10(11)13-14-15/h5-8H,3-4H2,1-2H3,(H,16,17)