hexyl 2-(2,3-dihydro-1H-1,2,3-triazol-4-ylsulfanyl)hexanoate

Systemtic Name: hexyl 2-(2,3-dihydro-1H-1,2,3-triazol-4-ylsulfanyl)hexanoate Openeye Name: hexyl 2-(2,3-dihydro-1H-triazol-4-ylsulfanyl)hexanoate CAS Name: 2-(2,3-dihydro-1H-triazol-4-ylthio)hexanoic acid hexyl ester IUPAC Name: hexyl 2-(2,3-dihydro-1H-triazol-4-ylsulfanyl)hexanoate Traditional Name: 2-(2,3-dihydro-1H-triazol-4-ylthio)hexanoic acid hexyl ester Formula: C14H27N3O2S MolecularWeight: 301.44808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(CCCC)SC1=CNNN1

Isomeric SMILES

CCCCCCOC(=O)C(CCCC)SC1=CNNN1

InChI

InChI=1S/C14H27N3O2S/c1-3-5-7-8-10-19-14(18)12(9-6-4-2)20-13-11-15-17-16-13/h11-12,15-17H,3-10H2,1-2H3