methyl 1-(3-chloranyl-2-oxidanyl-propyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-(3-chloranyl-2-oxidanyl-propyl)-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-(3-chloro-2-hydroxy-propyl)triazole-4-carboxylate CAS Name: 1-(3-chloro-2-hydroxypropyl)-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-chloro-2-hydroxypropyl)triazole-4-carboxylate Traditional Name: 1-(3-chloro-2-hydroxy-propyl)triazole-4-carboxylic acid methyl ester Formula: C7H10ClN3O3 MolecularWeight: 219.6256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=N1)CC(CCl)O

Isomeric SMILES

COC(=O)C1=CN(N=N1)CC(CCl)O

InChI

InChI=1S/C7H10ClN3O3/c1-14-7(13)6-4-11(10-9-6)3-5(12)2-8/h4-5,12H,2-3H2,1H3