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

Systemtic Name: 5-[(4-bromanyl-3-methyl-phenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(4-bromo-3-methyl-phenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[(4-bromo-3-methylphenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-bromo-3-methylphenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(4-bromo-3-methyl-phenoxy)methyl]-3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazole Formula: C18H17BrN2O4 MolecularWeight: 405.24258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC(=NO2)C3=CC(=C(C=C3)OC)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC(=NO2)C3=CC(=C(C=C3)OC)OC)Br

InChI

InChI=1S/C18H17BrN2O4/c1-11-8-13(5-6-14(11)19)24-10-17-20-18(21-25-17)12-4-7-15(22-2)16(9-12)23-3/h4-9H,10H2,1-3H3