tert-butyl 6-cyclohexyl-3-[3-(1,2,4-triazol-1-ylmethyl)-1,2,4-oxadiazol-5-yl]hexanoate

Systemtic Name: tert-butyl 6-cyclohexyl-3-[3-(1,2,4-triazol-1-ylmethyl)-1,2,4-oxadiazol-5-yl]hexanoate Openeye Name: tert-butyl 6-cyclohexyl-3-[3-(1,2,4-triazol-1-ylmethyl)-1,2,4-oxadiazol-5-yl]hexanoate CAS Name: 6-cyclohexyl-3-[3-(1,2,4-triazol-1-ylmethyl)-1,2,4-oxadiazol-5-yl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 6-cyclohexyl-3-[3-(1,2,4-triazol-1-ylmethyl)-1,2,4-oxadiazol-5-yl]hexanoate Traditional Name: 6-cyclohexyl-3-[3-(1,2,4-triazol-1-ylmethyl)-1,2,4-oxadiazol-5-yl]hexanoic acid tert-butyl ester Formula: C21H33N5O3 MolecularWeight: 403.51842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)CN3C=NC=N3

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)CN3C=NC=N3

InChI

InChI=1S/C21H33N5O3/c1-21(2,3)28-19(27)12-17(11-7-10-16-8-5-4-6-9-16)20-24-18(25-29-20)13-26-15-22-14-23-26/h14-17H,4-13H2,1-3H3