3-[3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)propanamide

Systemtic Name: 3-[3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)propanamide Openeye Name: 3-[3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-N-(o-tolyl)propanamide CAS Name: 3-[3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)propanamide IUPAC Name: 3-[3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-methylphenyl)propanamide Traditional Name: 3-[3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-N-(o-tolyl)propionamide Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2=NOC(=N2)CCC(=O)NC3=CC=CC=C3C)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2=NOC(=N2)CCC(=O)NC3=CC=CC=C3C)Br)OC

InChI

InChI=1S/C21H22BrN3O4/c1-4-28-17-12-14(11-15(22)20(17)27-3)21-24-19(29-25-21)10-9-18(26)23-16-8-6-5-7-13(16)2/h5-8,11-12H,4,9-10H2,1-3H3,(H,23,26)