5-bromanyl-3-methyl-N-[4-(4-prop-2-enoxyphenyl)-1,2,5-oxadiazol-3-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-3-methyl-N-[4-(4-prop-2-enoxyphenyl)-1,2,5-oxadiazol-3-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[4-(4-allyloxyphenyl)-1,2,5-oxadiazol-3-yl]-5-bromo-3-methyl-benzofuran-2-carboxamide CAS Name: 5-bromo-3-methyl-N-[4-(4-prop-2-enoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-benzofurancarboxamide IUPAC Name: 5-bromo-3-methyl-N-[4-(4-prop-2-enoxyphenyl)-1,2,5-oxadiazol-3-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[4-(4-allyloxyphenyl)furazan-3-yl]-5-bromo-3-methyl-coumarilamide Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NC3=NON=C3C4=CC=C(C=C4)OCC=C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)Br)C(=O)NC3=NON=C3C4=CC=C(C=C4)OCC=C

InChI

InChI=1S/C21H16BrN3O4/c1-3-10-27-15-7-4-13(5-8-15)18-20(25-29-24-18)23-21(26)19-12(2)16-11-14(22)6-9-17(16)28-19/h3-9,11H,1,10H2,2H3,(H,23,25,26)