N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propionamide Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=NC(=NO2)C3=CC=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=NC(=NO2)C3=CC=CC=C3)Br)OC

InChI

InChI=1S/C21H22BrN3O4/c1-27-17-12-15(16(22)13-18(17)28-2)10-11-23-19(26)8-9-20-24-21(25-29-20)14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3,(H,23,26)