(2E)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[[3-methoxy-4-(2-thienylmethoxy)phenyl]methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-[3-methoxy-4-(2-thenyloxy)phenyl]-2-pivaloyl-acrylonitrile Formula: C20H21NO3S MolecularWeight: 355.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=CS2)OC)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC(=C(C=C1)OCC2=CC=CS2)OC)/C#N

InChI

InChI=1S/C20H21NO3S/c1-20(2,3)19(22)15(12-21)10-14-7-8-17(18(11-14)23-4)24-13-16-6-5-9-25-16/h5-11H,13H2,1-4H3/b15-10+