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

Systemtic Name: tert-butyl 3-[3-[(4-chloranylphenoxy)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate Openeye Name: tert-butyl 3-[3-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate CAS Name: 3-[3-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoate Traditional Name: 3-[3-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoic acid tert-butyl ester Formula: C25H35ClN2O4 MolecularWeight: 463.0094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)COC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CC(CCCC1CCCCC1)C2=NC(=NO2)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H35ClN2O4/c1-25(2,3)31-23(29)16-19(11-7-10-18-8-5-4-6-9-18)24-27-22(28-32-24)17-30-21-14-12-20(26)13-15-21/h12-15,18-19H,4-11,16-17H2,1-3H3