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

Systemtic Name: tert-butyl 3-[3-[[(2-azanyl-2-oxidanylidene-ethyl)-methyl-amino]methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate Openeye Name: tert-butyl 3-[3-[[(2-amino-2-oxo-ethyl)-methyl-amino]methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate CAS Name: 3-[3-[[(2-amino-2-oxoethyl)-methylamino]methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-[[(2-amino-2-oxoethyl)-methylamino]methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoate Traditional Name: 3-[3-[[(2-amino-2-keto-ethyl)-methyl-amino]methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoic acid tert-butyl ester Formula: C22H38N4O4 MolecularWeight: 422.56152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)CN(C)CC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)CN(C)CC(=O)N

InChI

InChI=1S/C22H38N4O4/c1-22(2,3)29-20(28)13-17(12-8-11-16-9-6-5-7-10-16)21-24-19(25-30-21)15-26(4)14-18(23)27/h16-17H,5-15H2,1-4H3,(H2,23,27)