4-[[5-methyl-1-(4-propan-2-ylphenyl)-1,2,3-triazol-4-yl]carbonylamino]benzoate

Systemtic Name: 4-[[5-methyl-1-(4-propan-2-ylphenyl)-1,2,3-triazol-4-yl]carbonylamino]benzoate Openeye Name: 4-[[1-(4-isopropylphenyl)-5-methyl-triazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[5-methyl-1-(4-propan-2-ylphenyl)-4-triazolyl]-oxomethyl]amino]benzoate IUPAC Name: 4-[[5-methyl-1-(4-propan-2-ylphenyl)triazole-4-carbonyl]amino]benzoate Traditional Name: 4-[(5-methyl-1-p-cumenyl-triazole-4-carbonyl)amino]benzoate Formula: C20H19N4O3- MolecularWeight: 363.38986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=C(C=C2)C(C)C)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=C(N=NN1C2=CC=C(C=C2)C(C)C)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C20H20N4O3/c1-12(2)14-6-10-17(11-7-14)24-13(3)18(22-23-24)19(25)21-16-8-4-15(5-9-16)20(26)27/h4-12H,1-3H3,(H,21,25)(H,26,27)/p-1