1-[(2S)-3-methylbutan-2-yl]benzotriazole-5-carboxylic acid

Systemtic Name: 1-[(2S)-3-methylbutan-2-yl]benzotriazole-5-carboxylic acid Openeye Name: 1-[(1S)-1,2-dimethylpropyl]benzotriazole-5-carboxylic acid CAS Name: 1-[(2S)-3-methylbutan-2-yl]-5-benzotriazolecarboxylic acid IUPAC Name: 1-[(2S)-3-methylbutan-2-yl]benzotriazole-5-carboxylic acid Traditional Name: 1-[(1S)-1,2-dimethylpropyl]benzotriazole-5-carboxylic acid Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(C)C)N1C2=C(C=C(C=C2)C(=O)O)N=N1

InChI

InChI=1S/C12H15N3O2/c1-7(2)8(3)15-11-5-4-9(12(16)17)6-10(11)13-14-15/h4-8H,1-3H3,(H,16,17)/t8-/m0/s1