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

Systemtic Name: tert-butyl (3R)-6-cyclohexyl-3-[3-[(4-oxidanylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl]hexanoate Openeye Name: tert-butyl (3R)-6-cyclohexyl-3-[3-[(4-hydroxypiperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl]hexanoate CAS Name: (3R)-6-cyclohexyl-3-[3-[(4-hydroxy-1-piperazinyl)methyl]-1,2,4-oxadiazol-5-yl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-6-cyclohexyl-3-[3-[(4-hydroxypiperazin-1-yl)methyl]-1,2,4-oxadiazol-5-yl]hexanoate Traditional Name: (3R)-6-cyclohexyl-3-[3-[(4-hydroxypiperazino)methyl]-1,2,4-oxadiazol-5-yl]hexanoic acid tert-butyl ester Formula: C23H40N4O4 MolecularWeight: 436.5881

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)CN3CCN(CC3)O

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](CCCC1CCCCC1)C2=NC(=NO2)CN3CCN(CC3)O

InChI

InChI=1S/C23H40N4O4/c1-23(2,3)30-21(28)16-19(11-7-10-18-8-5-4-6-9-18)22-24-20(25-31-22)17-26-12-14-27(29)15-13-26/h18-19,29H,4-17H2,1-3H3/t19-/m1/s1