2-(2-bromanyl-4,5-dimethoxy-phenyl)-N-[2-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)ethyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4,5-dimethoxy-phenyl)-N-[2-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)ethyl]ethanamide Openeye Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]acetamide CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)-N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]acetamide IUPAC Name: 2-(2-bromo-4,5-dimethoxyphenyl)-N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]acetamide Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]acetamide Formula: C20H21BrFNO5 MolecularWeight: 454.286843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)NCCC2=C3C(=CC(=C2)F)COCO3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)NCCC2=C3C(=CC(=C2)F)COCO3)Br)OC

InChI

InChI=1S/C20H21BrFNO5/c1-25-17-7-13(16(21)9-18(17)26-2)8-19(24)23-4-3-12-5-15(22)6-14-10-27-11-28-20(12)14/h5-7,9H,3-4,8,10-11H2,1-2H3,(H,23,24)