5-(4-dodecoxyphenyl)-4-[tris(bromanyl)methyl]-1,2,3-oxadiazole

Systemtic Name: 5-(4-dodecoxyphenyl)-4-[tris(bromanyl)methyl]-1,2,3-oxadiazole Openeye Name: 5-(4-dodecoxyphenyl)-4-(tribromomethyl)oxadiazole CAS Name: 5-(4-dodecoxyphenyl)-4-(tribromomethyl)oxadiazole IUPAC Name: 5-(4-dodecoxyphenyl)-4-(tribromomethyl)oxadiazole Traditional Name: 5-(4-lauryloxyphenyl)-4-(tribromomethyl)oxadiazole Formula: C21H29Br3N2O2 MolecularWeight: 581.17916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(N=NO2)C(Br)(Br)Br

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(N=NO2)C(Br)(Br)Br

InChI

InChI=1S/C21H29Br3N2O2/c1-2-3-4-5-6-7-8-9-10-11-16-27-18-14-12-17(13-15-18)19-20(21(22,23)24)25-26-28-19/h12-15H,2-11,16H2,1H3