methyl 5-azanyl-1-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 5-amino-1-[2-(2,6-dimethylanilino)-2-oxo-ethyl]triazole-4-carboxylate CAS Name: 5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[2-(2,6-dimethylanilino)-2-oxoethyl]triazole-4-carboxylate Traditional Name: 5-amino-1-[2-(2,6-dimethylanilino)-2-keto-ethyl]triazole-4-carboxylic acid methyl ester Formula: C14H17N5O3 MolecularWeight: 303.31648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=C(N=N2)C(=O)OC)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2C(=C(N=N2)C(=O)OC)N

InChI

InChI=1S/C14H17N5O3/c1-8-5-4-6-9(2)11(8)16-10(20)7-19-13(15)12(17-18-19)14(21)22-3/h4-6H,7,15H2,1-3H3,(H,16,20)