(E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-quinoxalin-2-yl-prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-quinoxalin-2-yl-prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-quinoxalin-2-yl-prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(2-quinoxalinyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-quinoxalin-2-ylprop-2-enamide Traditional Name: (E)-2-cyano-N-piperonyl-3-quinoxalin-2-yl-acrylamide Formula: C20H14N4O3 MolecularWeight: 358.35016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(=CC3=NC4=CC=CC=C4N=C3)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)/C(=C/C3=NC4=CC=CC=C4N=C3)/C#N

InChI

InChI=1S/C20H14N4O3/c21-9-14(8-15-11-22-16-3-1-2-4-17(16)24-15)20(25)23-10-13-5-6-18-19(7-13)27-12-26-18/h1-8,11H,10,12H2,(H,23,25)/b14-8+