5-(2-methylprop-1-enyl)-1-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-(2-methylprop-1-enyl)-1-(4-propan-2-ylphenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(4-isopropylphenyl)-5-(2-methylprop-1-enyl)triazole-4-carboxylic acid CAS Name: 5-(2-methylprop-1-enyl)-1-(4-propan-2-ylphenyl)-4-triazolecarboxylic acid IUPAC Name: 5-(2-methylprop-1-enyl)-1-(4-propan-2-ylphenyl)triazole-4-carboxylic acid Traditional Name: 5-(2-methylprop-1-enyl)-1-p-cumenyl-triazole-4-carboxylic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)C=C(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)C=C(C)C

InChI

InChI=1S/C16H19N3O2/c1-10(2)9-14-15(16(20)21)17-18-19(14)13-7-5-12(6-8-13)11(3)4/h5-9,11H,1-4H3,(H,20,21)