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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromanyl-3,4-dimethoxy-phenyl)ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromo-3,4-dimethoxy-phenyl)acetamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromo-3,4-dimethoxyphenyl)acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-bromo-3,4-dimethoxyphenyl)acetamide Traditional Name: 2-(2-bromo-3,4-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/c1-23-15-6-4-13(18(20)19(15)24-2)10-17(22)21-8-7-12-3-5-14-16(9-12)26-11-25-14/h3-6,9H,7-8,10-11H2,1-2H3,(H,21,22)