tert-butyl 6-cyclohexyl-3-[3-[[(4-oxidanylcyclohexyl)amino]methyl]-1,2,4-oxadiazol-5-yl]hexanoate

Systemtic Name: tert-butyl 6-cyclohexyl-3-[3-[[(4-oxidanylcyclohexyl)amino]methyl]-1,2,4-oxadiazol-5-yl]hexanoate Openeye Name: tert-butyl 6-cyclohexyl-3-[3-[[(4-hydroxycyclohexyl)amino]methyl]-1,2,4-oxadiazol-5-yl]hexanoate CAS Name: 6-cyclohexyl-3-[3-[[(4-hydroxycyclohexyl)amino]methyl]-1,2,4-oxadiazol-5-yl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 6-cyclohexyl-3-[3-[[(4-hydroxycyclohexyl)amino]methyl]-1,2,4-oxadiazol-5-yl]hexanoate Traditional Name: 6-cyclohexyl-3-[3-[[(4-hydroxycyclohexyl)amino]methyl]-1,2,4-oxadiazol-5-yl]hexanoic acid tert-butyl ester Formula: C25H43N3O4 MolecularWeight: 449.62662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)CNC3CCC(CC3)O

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)CNC3CCC(CC3)O

InChI

InChI=1S/C25H43N3O4/c1-25(2,3)31-23(30)16-19(11-7-10-18-8-5-4-6-9-18)24-27-22(28-32-24)17-26-20-12-14-21(29)15-13-20/h18-21,26,29H,4-17H2,1-3H3