(E)-2-oxidanylidene-4-(3,4,5-trimethoxyphenyl)but-3-enenitrile

Systemtic Name: (E)-2-oxidanylidene-4-(3,4,5-trimethoxyphenyl)but-3-enenitrile Openeye Name: (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl cyanide CAS Name: (E)-2-oxo-4-(3,4,5-trimethoxyphenyl)-3-butenenitrile IUPAC Name: (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl cyanide Traditional Name: (E)-2-keto-4-(3,4,5-trimethoxyphenyl)but-3-enenitrile Formula: C13H13NO4 MolecularWeight: 247.24662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CC(=O)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)C#N

InChI

InChI=1S/C13H13NO4/c1-16-11-6-9(4-5-10(15)8-14)7-12(17-2)13(11)18-3/h4-7H,1-3H3/b5-4+