1-(3,4-dimethylphenyl)-5-ethyl-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-(3,4-dimethylphenyl)-5-ethyl-1,2,3-triazole-4-carboxylate Openeye Name: 1-(3,4-dimethylphenyl)-5-ethyl-triazole-4-carboxylate CAS Name: 1-(3,4-dimethylphenyl)-5-ethyl-4-triazolecarboxylate IUPAC Name: 1-(3,4-dimethylphenyl)-5-ethyltriazole-4-carboxylate Traditional Name: 1-(3,4-dimethylphenyl)-5-ethyl-triazole-4-carboxylate Formula: C13H14N3O2- MolecularWeight: 244.26916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=NN1C2=CC(=C(C=C2)C)C)C(=O)[O-]

Isomeric SMILES

CCC1=C(N=NN1C2=CC(=C(C=C2)C)C)C(=O)[O-]

InChI

InChI=1S/C13H15N3O2/c1-4-11-12(13(17)18)14-15-16(11)10-6-5-8(2)9(3)7-10/h5-7H,4H2,1-3H3,(H,17,18)/p-1