3-chloranyl-4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-chloro-4-[2-(3,4-dimethoxyphenyl)-2-oxo-ethoxy]benzonitrile CAS Name: 3-chloro-4-[2-(3,4-dimethoxyphenyl)-2-oxoethoxy]benzonitrile IUPAC Name: 3-chloro-4-[2-(3,4-dimethoxyphenyl)-2-oxoethoxy]benzonitrile Traditional Name: 3-chloro-4-[2-(3,4-dimethoxyphenyl)-2-keto-ethoxy]benzonitrile Formula: C17H14ClNO4 MolecularWeight: 331.75036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC2=C(C=C(C=C2)C#N)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC2=C(C=C(C=C2)C#N)Cl)OC

InChI

InChI=1S/C17H14ClNO4/c1-21-16-6-4-12(8-17(16)22-2)14(20)10-23-15-5-3-11(9-19)7-13(15)18/h3-8H,10H2,1-2H3