1-[2-[cyclohexyl(ethyl)azaniumyl]ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-[cyclohexyl(ethyl)azaniumyl]ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-[cyclohexyl(ethyl)ammonio]ethyl]triazole-4-carboxylate CAS Name: 1-[2-[cyclohexyl(ethyl)ammonio]ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-[cyclohexyl(ethyl)azaniumyl]ethyl]triazole-4-carboxylate Traditional Name: 1-[2-[cyclohexyl(ethyl)ammonio]ethyl]triazole-4-carboxylate Formula: C13H22N4O2 MolecularWeight: 266.33938

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCN1C=C(N=N1)C(=O)[O-])C2CCCCC2

Isomeric SMILES

CC[NH+](CCN1C=C(N=N1)C(=O)[O-])C2CCCCC2

InChI

InChI=1S/C13H22N4O2/c1-2-16(11-6-4-3-5-7-11)8-9-17-10-12(13(18)19)14-15-17/h10-11H,2-9H2,1H3,(H,18,19)