5-[(2-bromanyl-4-ethyl-phenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(2-bromanyl-4-ethyl-phenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(2-bromo-4-ethyl-phenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[(2-bromo-4-ethylphenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2-bromo-4-ethylphenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(2-bromo-4-ethyl-phenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC(=C(C=C3)OC)OC)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC(=C(C=C3)OC)OC)Br

InChI

InChI=1S/C19H19BrN2O4/c1-4-12-5-7-15(14(20)9-12)25-11-18-21-19(22-26-18)13-6-8-16(23-2)17(10-13)24-3/h5-10H,4,11H2,1-3H3