(E)-N-(4-acetamidophenyl)-3-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-N-(4-acetamidophenyl)-3-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-3-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-cyano-acrylamide Formula: C20H16ClN3O4 MolecularWeight: 397.81174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=CC2=CC3=C(C(=C2)Cl)OCCO3)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC3=C(C(=C2)Cl)OCCO3)/C#N

InChI

InChI=1S/C20H16ClN3O4/c1-12(25)23-15-2-4-16(5-3-15)24-20(26)14(11-22)8-13-9-17(21)19-18(10-13)27-6-7-28-19/h2-5,8-10H,6-7H2,1H3,(H,23,25)(H,24,26)/b14-8+