2-[3-(4,7-dimethoxy-6-oxidanyl-1-benzofuran-5-yl)-3-oxidanylidene-1-phenyl-propyl]propanedinitrile

Systemtic Name: 2-[3-(4,7-dimethoxy-6-oxidanyl-1-benzofuran-5-yl)-3-oxidanylidene-1-phenyl-propyl]propanedinitrile Openeye Name: 2-[3-(6-hydroxy-4,7-dimethoxy-benzofuran-5-yl)-3-oxo-1-phenyl-propyl]propanedinitrile CAS Name: 2-[3-(6-hydroxy-4,7-dimethoxy-5-benzofuranyl)-3-oxo-1-phenylpropyl]propanedinitrile IUPAC Name: 2-[3-(6-hydroxy-4,7-dimethoxy-1-benzofuran-5-yl)-3-oxo-1-phenylpropyl]propanedinitrile Traditional Name: 2-[3-(6-hydroxy-4,7-dimethoxy-benzofuran-5-yl)-3-keto-1-phenyl-propyl]malononitrile Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1C=CO2)OC)O)C(=O)CC(C3=CC=CC=C3)C(C#N)C#N

Isomeric SMILES

COC1=C(C(=C(C2=C1C=CO2)OC)O)C(=O)CC(C3=CC=CC=C3)C(C#N)C#N

InChI

InChI=1S/C22H18N2O5/c1-27-20-15-8-9-29-21(15)22(28-2)19(26)18(20)17(25)10-16(14(11-23)12-24)13-6-4-3-5-7-13/h3-9,14,16,26H,10H2,1-2H3