2-(1-adamantyl)-5-[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]-1,3,4-oxadiazole

Systemtic Name: 2-(1-adamantyl)-5-[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]-1,3,4-oxadiazole Openeye Name: 2-(1-adamantyl)-5-[3-[(2-bromophenoxy)methyl]-4-methoxy-phenyl]-1,3,4-oxadiazole CAS Name: 2-(1-adamantyl)-5-[3-[(2-bromophenoxy)methyl]-4-methoxyphenyl]-1,3,4-oxadiazole IUPAC Name: 2-(1-adamantyl)-5-[3-[(2-bromophenoxy)methyl]-4-methoxyphenyl]-1,3,4-oxadiazole Traditional Name: 2-(1-adamantyl)-5-[3-[(2-bromophenoxy)methyl]-4-methoxy-phenyl]-1,3,4-oxadiazole Formula: C26H27BrN2O3 MolecularWeight: 495.40818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(O2)C34CC5CC(C3)CC(C5)C4)COC6=CC=CC=C6Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(O2)C34CC5CC(C3)CC(C5)C4)COC6=CC=CC=C6Br

InChI

InChI=1S/C26H27BrN2O3/c1-30-22-7-6-19(11-20(22)15-31-23-5-3-2-4-21(23)27)24-28-29-25(32-24)26-12-16-8-17(13-26)10-18(9-16)14-26/h2-7,11,16-18H,8-10,12-15H2,1H3