propan-2-yl 3-azanyl-1H-1,2,4-triazole-5-carboxylate hydrochloride

Systemtic Name: propan-2-yl 3-azanyl-1H-1,2,4-triazole-5-carboxylate hydrochloride Openeye Name: isopropyl 3-amino-1H-1,2,4-triazole-5-carboxylate hydrochloride CAS Name: 3-amino-1H-1,2,4-triazole-5-carboxylic acid propan-2-yl ester hydrochloride IUPAC Name: propan-2-yl 3-amino-1H-1,2,4-triazole-5-carboxylate hydrochloride Traditional Name: 3-amino-1H-1,2,4-triazole-5-carboxylic acid isopropyl ester hydrochloride Formula: C6H11ClN4O2 MolecularWeight: 206.63014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=NC(=NN1)N.Cl

Isomeric SMILES

CC(C)OC(=O)C1=NC(=NN1)N.Cl

InChI

InChI=1S/C6H10N4O2.ClH/c1-3(2)12-5(11)4-8-6(7)10-9-4;/h3H,1-2H3,(H3,7,8,9,10);1H