2-(1,4-dimethoxynaphthalen-2-yl)-2-(1-oxidanyl-3-oxidanylidene-2-benzofuran-1-yl)ethanenitrile

Systemtic Name: 2-(1,4-dimethoxynaphthalen-2-yl)-2-(1-oxidanyl-3-oxidanylidene-2-benzofuran-1-yl)ethanenitrile Openeye Name: 2-(1,4-dimethoxy-2-naphthyl)-2-(1-hydroxy-3-oxo-isobenzofuran-1-yl)acetonitrile CAS Name: 2-(1,4-dimethoxy-2-naphthalenyl)-2-(1-hydroxy-3-oxo-1-isobenzofuranyl)acetonitrile IUPAC Name: 2-(1,4-dimethoxynaphthalen-2-yl)-2-(1-hydroxy-3-oxo-2-benzofuran-1-yl)acetonitrile Traditional Name: 2-(1,4-dimethoxy-2-naphthyl)-2-(1-hydroxy-3-keto-phthalan-1-yl)acetonitrile Formula: C22H17NO5 MolecularWeight: 375.37408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=CC=CC=C21)OC)C(C#N)C3(C4=CC=CC=C4C(=O)O3)O

Isomeric SMILES

COC1=CC(=C(C2=CC=CC=C21)OC)C(C#N)C3(C4=CC=CC=C4C(=O)O3)O

InChI

InChI=1S/C22H17NO5/c1-26-19-11-16(20(27-2)14-8-4-3-7-13(14)19)18(12-23)22(25)17-10-6-5-9-15(17)21(24)28-22/h3-11,18,25H,1-2H3