(E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[[(2R)-oxolan-2-yl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[[(2R)-oxolan-2-yl]methyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[[(2R)-tetrahydrofuran-2-yl]methyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[[(2R)-2-oxolanyl]methyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[[(2R)-oxolan-2-yl]methyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acrylamide Formula: C16H16N2O4 MolecularWeight: 300.30924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)/C(=C/C2=CC3=C(C=C2)OCO3)/C#N

InChI

InChI=1S/C16H16N2O4/c17-8-12(16(19)18-9-13-2-1-5-20-13)6-11-3-4-14-15(7-11)22-10-21-14/h3-4,6-7,13H,1-2,5,9-10H2,(H,18,19)/b12-6+/t13-/m1/s1