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

Systemtic Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)-1,2,3-triazol-4-yl]ethanoate Openeye Name: 2-[1-(4-isopropylphenyl)-5-methyl-triazol-4-yl]acetate CAS Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)-4-triazolyl]acetate IUPAC Name: 2-[5-methyl-1-(4-propan-2-ylphenyl)triazol-4-yl]acetate Traditional Name: 2-(5-methyl-1-p-cumenyl-triazol-4-yl)acetate Formula: C14H16N3O2- MolecularWeight: 258.29574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O2/c1-9(2)11-4-6-12(7-5-11)17-10(3)13(15-16-17)8-14(18)19/h4-7,9H,8H2,1-3H3,(H,18,19)/p-1