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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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