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

Systemtic Name: tert-butyl 6-cyclohexyl-3-[3-[1-(diphenylmethyl)azetidin-3-yl]-1,2,4-oxadiazol-5-yl]hexanoate Openeye Name: tert-butyl 3-[3-(1-benzhydrylazetidin-3-yl)-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate CAS Name: 6-cyclohexyl-3-[3-[1-(diphenylmethyl)-3-azetidinyl]-1,2,4-oxadiazol-5-yl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-(1-benzhydrylazetidin-3-yl)-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoate Traditional Name: 3-[3-(1-benzhydrylazetidin-3-yl)-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoic acid tert-butyl ester Formula: C34H45N3O3 MolecularWeight: 543.7394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)C3CN(C3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)C3CN(C3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H45N3O3/c1-34(2,3)39-30(38)22-28(21-13-16-25-14-7-4-8-15-25)33-35-32(36-40-33)29-23-37(24-29)31(26-17-9-5-10-18-26)27-19-11-6-12-20-27/h5-6,9-12,17-20,25,28-29,31H,4,7-8,13-16,21-24H2,1-3H3