5-(2-chloranylethanoylamino)-1-methyl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 5-(2-chloranylethanoylamino)-1-methyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-[(2-chloroacetyl)amino]-1-methyl-1,2,4-triazole-3-carboxylic acid CAS Name: 5-[(2-chloro-1-oxoethyl)amino]-1-methyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-[(2-chloroacetyl)amino]-1-methyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-[(2-chloroacetyl)amino]-1-methyl-1,2,4-triazole-3-carboxylic acid Formula: C6H7ClN4O3 MolecularWeight: 218.59778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)C(=O)O)NC(=O)CCl

Isomeric SMILES

CN1C(=NC(=N1)C(=O)O)NC(=O)CCl

InChI

InChI=1S/C6H7ClN4O3/c1-11-6(8-3(12)2-7)9-4(10-11)5(13)14/h2H2,1H3,(H,13,14)(H,8,9,10,12)