3-(4-bromophenyl)-5-(4-heptylphenyl)-1,2,4-oxadiazole

Systemtic Name: 3-(4-bromophenyl)-5-(4-heptylphenyl)-1,2,4-oxadiazole Openeye Name: 3-(4-bromophenyl)-5-(4-heptylphenyl)-1,2,4-oxadiazole CAS Name: 3-(4-bromophenyl)-5-(4-heptylphenyl)-1,2,4-oxadiazole IUPAC Name: 3-(4-bromophenyl)-5-(4-heptylphenyl)-1,2,4-oxadiazole Traditional Name: 3-(4-bromophenyl)-5-(4-heptylphenyl)-1,2,4-oxadiazole Formula: C21H23BrN2O MolecularWeight: 399.32412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC(=NO2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC(=NO2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN2O/c1-2-3-4-5-6-7-16-8-10-18(11-9-16)21-23-20(24-25-21)17-12-14-19(22)15-13-17/h8-15H,2-7H2,1H3