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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]propionamide Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=CC3=C(C=C2)OCO3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=CC3=C(C=C2)OCO3)Br)OC

InChI

InChI=1S/C20H22BrNO5/c1-24-17-10-14(15(21)11-18(17)25-2)7-8-22-20(23)6-4-13-3-5-16-19(9-13)27-12-26-16/h3,5,9-11H,4,6-8,12H2,1-2H3,(H,22,23)