methyl 5-azanyl-1-(4-chloranyl-2-methyl-phenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-(4-chloranyl-2-methyl-phenyl)-1,2,3-triazole-4-carboxylate Openeye Name: methyl 5-amino-1-(4-chloro-2-methyl-phenyl)triazole-4-carboxylate CAS Name: 5-amino-1-(4-chloro-2-methylphenyl)-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-(4-chloro-2-methylphenyl)triazole-4-carboxylate Traditional Name: 5-amino-1-(4-chloro-2-methyl-phenyl)triazole-4-carboxylic acid methyl ester Formula: C11H11ClN4O2 MolecularWeight: 266.68364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N2C(=C(N=N2)C(=O)OC)N

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N2C(=C(N=N2)C(=O)OC)N

InChI

InChI=1S/C11H11ClN4O2/c1-6-5-7(12)3-4-8(6)16-10(13)9(14-15-16)11(17)18-2/h3-5H,13H2,1-2H3