1-[2-[(2R)-octan-2-yl]oxyethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-[(2R)-octan-2-yl]oxyethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-[(1R)-1-methylheptoxy]ethyl]triazole-4-carboxylate CAS Name: 1-[2-[(2R)-octan-2-yl]oxyethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-[(2R)-octan-2-yl]oxyethyl]triazole-4-carboxylate Traditional Name: 1-[2-[(1R)-1-methylheptoxy]ethyl]triazole-4-carboxylate Formula: C13H22N3O3- MolecularWeight: 268.33208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OCCN1C=C(N=N1)C(=O)[O-]

Isomeric SMILES

CCCCCC[C@@H](C)OCCN1C=C(N=N1)C(=O)[O-]

InChI

InChI=1S/C13H23N3O3/c1-3-4-5-6-7-11(2)19-9-8-16-10-12(13(17)18)14-15-16/h10-11H,3-9H2,1-2H3,(H,17,18)/p-1/t11-/m1/s1