1-(2-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(2-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2-isopropylphenyl)triazole-4-carboxylic acid CAS Name: 1-(2-propan-2-ylphenyl)-4-triazolecarboxylic acid IUPAC Name: 1-(2-propan-2-ylphenyl)triazole-4-carboxylic acid Traditional Name: 1-o-cumenyltriazole-4-carboxylic acid Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C=C(N=N2)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C=C(N=N2)C(=O)O

InChI

InChI=1S/C12H13N3O2/c1-8(2)9-5-3-4-6-11(9)15-7-10(12(16)17)13-14-15/h3-8H,1-2H3,(H,16,17)