(2E)-2-(3,4-dimethoxyphenyl)-2-(3-oxidanylidene-2-benzofuran-1-ylidene)ethanenitrile

Systemtic Name: (2E)-2-(3,4-dimethoxyphenyl)-2-(3-oxidanylidene-2-benzofuran-1-ylidene)ethanenitrile Openeye Name: (2E)-2-(3,4-dimethoxyphenyl)-2-(3-oxoisobenzofuran-1-ylidene)acetonitrile CAS Name: (2E)-2-(3,4-dimethoxyphenyl)-2-(3-oxo-1-isobenzofuranylidene)acetonitrile IUPAC Name: (2E)-2-(3,4-dimethoxyphenyl)-2-(3-oxo-2-benzofuran-1-ylidene)acetonitrile Traditional Name: (2E)-2-(3,4-dimethoxyphenyl)-2-phthalidylidene-acetonitrile Formula: C18H13NO4 MolecularWeight: 307.30012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=C2C3=CC=CC=C3C(=O)O2)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C\2/C3=CC=CC=C3C(=O)O2)/C#N)OC

InChI

InChI=1S/C18H13NO4/c1-21-15-8-7-11(9-16(15)22-2)14(10-19)17-12-5-3-4-6-13(12)18(20)23-17/h3-9H,1-2H3/b17-14-