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

Systemtic Name: (E)-2-cyano-N-(2,3-dimethylphenyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,3-dimethylphenyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2,3-dimethylphenyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,3-dimethylphenyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,3-dimethylphenyl)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)acrylamide Formula: C21H20N2O4 MolecularWeight: 364.3945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C(=CC2=CC3=C(C(=C2)OC)OCCO3)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)/C(=C/C2=CC3=C(C(=C2)OC)OCCO3)/C#N)C

InChI

InChI=1S/C21H20N2O4/c1-13-5-4-6-17(14(13)2)23-21(24)16(12-22)9-15-10-18(25-3)20-19(11-15)26-7-8-27-20/h4-6,9-11H,7-8H2,1-3H3,(H,23,24)/b16-9+