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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromo-4,5-dimethoxy-phenyl)acetamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromo-4,5-dimethoxyphenyl)acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromo-4,5-dimethoxyphenyl)acetamide Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-N-homopiperonyl-acetamide Formula: C19H20BrNO5 MolecularWeight: 422.2698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)NCCC2=CC3=C(C=C2)OCO3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)NCCC2=CC3=C(C=C2)OCO3)Br)OC

InChI

InChI=1S/C19H20BrNO5/c1-23-16-8-13(14(20)10-17(16)24-2)9-19(22)21-6-5-12-3-4-15-18(7-12)26-11-25-15/h3-4,7-8,10H,5-6,9,11H2,1-2H3,(H,21,22)