N,N'-bis(1,3-benzodioxol-5-ylmethyl)-2-bromanyl-propanediamide

Systemtic Name: N,N'-bis(1,3-benzodioxol-5-ylmethyl)-2-bromanyl-propanediamide Openeye Name: N,N'-bis(1,3-benzodioxol-5-ylmethyl)-2-bromo-propanediamide CAS Name: N,N'-bis(1,3-benzodioxol-5-ylmethyl)-2-bromopropanediamide IUPAC Name: N,N'-bis(1,3-benzodioxol-5-ylmethyl)-2-bromopropanediamide Traditional Name: 2-bromo-N,N'-dipiperonyl-malonamide Formula: C19H17BrN2O6 MolecularWeight: 449.25208

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(C(=O)NCC3=CC4=C(C=C3)OCO4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(C(=O)NCC3=CC4=C(C=C3)OCO4)Br

InChI

InChI=1S/C19H17BrN2O6/c20-17(18(23)21-7-11-1-3-13-15(5-11)27-9-25-13)19(24)22-8-12-2-4-14-16(6-12)28-10-26-14/h1-6,17H,7-10H2,(H,21,23)(H,22,24)