4-[2-(2,6-dimethylphenoxy)ethyl]-1,2,4-triazol-3-amine

Systemtic Name: 4-[2-(2,6-dimethylphenoxy)ethyl]-1,2,4-triazol-3-amine Openeye Name: 4-[2-(2,6-dimethylphenoxy)ethyl]-1,2,4-triazol-3-amine CAS Name: 4-[2-(2,6-dimethylphenoxy)ethyl]-1,2,4-triazol-3-amine IUPAC Name: 4-[2-(2,6-dimethylphenoxy)ethyl]-1,2,4-triazol-3-amine Traditional Name: [4-[2-(2,6-dimethylphenoxy)ethyl]-1,2,4-triazol-3-yl]amine Formula: C12H16N4O MolecularWeight: 232.28164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCN2C=NN=C2N

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCN2C=NN=C2N

InChI

InChI=1S/C12H16N4O/c1-9-4-3-5-10(2)11(9)17-7-6-16-8-14-15-12(16)13/h3-5,8H,6-7H2,1-2H3,(H2,13,15)