N-[[1-(2-bromanylprop-2-enyl)benzimidazol-2-yl]methyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[[1-(2-bromanylprop-2-enyl)benzimidazol-2-yl]methyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[[1-(2-bromoallyl)benzimidazol-2-yl]methyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[1-(2-bromoprop-2-enyl)-2-benzimidazolyl]methyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[[1-(2-bromoprop-2-enyl)benzimidazol-2-yl]methyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[[1-(2-bromoallyl)benzimidazol-2-yl]methyl]-3,4,5-trimethoxy-benzamide Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=NC3=CC=CC=C3N2CC(=C)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=NC3=CC=CC=C3N2CC(=C)Br

InChI

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