3-(1,3-benzodioxol-5-yl)-N-[4-(4-bromanylphenoxy)phenyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(4-bromanylphenoxy)phenyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(4-bromophenoxy)phenyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(4-bromophenoxy)phenyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(4-bromophenoxy)phenyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[4-(4-bromophenoxy)phenyl]propionamide Formula: C22H18BrNO4 MolecularWeight: 440.28662

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrNO4/c23-16-3-7-18(8-4-16)28-19-9-5-17(6-10-19)24-22(25)12-2-15-1-11-20-21(13-15)27-14-26-20/h1,3-11,13H,2,12,14H2,(H,24,25)