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

Systemtic Name: 5-(4-bromophenyl)-3-(4-heptoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-(4-bromophenyl)-3-(4-heptoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-(4-bromophenyl)-3-(4-heptoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-(4-bromophenyl)-3-(4-heptoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-(4-bromophenyl)-3-(4-heptoxyphenyl)-1,2,4-oxadiazole Formula: C21H23BrN2O2 MolecularWeight: 415.32352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=NOC(=N2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=NOC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN2O2/c1-2-3-4-5-6-15-25-19-13-9-16(10-14-19)20-23-21(26-24-20)17-7-11-18(22)12-8-17/h7-14H,2-6,15H2,1H3