1-[2-[(2S)-2-ethylhexoxy]ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-[(2S)-2-ethylhexoxy]ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-[(2S)-2-ethylhexoxy]ethyl]triazole-4-carboxylate CAS Name: 1-[2-[(2S)-2-ethylhexoxy]ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-[(2S)-2-ethylhexoxy]ethyl]triazole-4-carboxylate Traditional Name: 1-[2-[(2S)-2-ethylhexoxy]ethyl]triazole-4-carboxylate Formula: C13H22N3O3- MolecularWeight: 268.33208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCCN1C=C(N=N1)C(=O)[O-]

Isomeric SMILES

CCCC[C@H](CC)COCCN1C=C(N=N1)C(=O)[O-]

InChI

InChI=1S/C13H23N3O3/c1-3-5-6-11(4-2)10-19-8-7-16-9-12(13(17)18)14-15-16/h9,11H,3-8,10H2,1-2H3,(H,17,18)/p-1/t11-/m0/s1