(E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(3-methoxy-2-propoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(3-methoxy-2-propoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(3-methoxy-2-propoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(3-methoxy-2-propoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-(3-methoxy-2-propoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3-methoxy-2-propoxy-phenyl)-N-piperonyl-acrylamide Formula: C22H22N2O5 MolecularWeight: 394.42048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1OC)C=C(C#N)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCOC1=C(C=CC=C1OC)/C=C(\C#N)/C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H22N2O5/c1-3-9-27-21-16(5-4-6-19(21)26-2)11-17(12-23)22(25)24-13-15-7-8-18-20(10-15)29-14-28-18/h4-8,10-11H,3,9,13-14H2,1-2H3,(H,24,25)/b17-11+