(2E)-4,4-dimethyl-2-[[4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-4,4-dimethyl-2-[[4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-4,4-dimethyl-2-[[4-(1-naphthylmethoxy)phenyl]methylene]-3-oxo-pentanenitrile CAS Name: (2E)-4,4-dimethyl-2-[[4-(1-naphthalenylmethoxy)phenyl]methylidene]-3-oxopentanenitrile IUPAC Name: (2E)-4,4-dimethyl-2-[[4-(naphthalen-1-ylmethoxy)phenyl]methylidene]-3-oxopentanenitrile Traditional Name: (E)-3-[4-(1-naphthylmethoxy)phenyl]-2-pivaloyl-acrylonitrile Formula: C25H23NO2 MolecularWeight: 369.45562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC=C(C=C1)OCC2=CC=CC3=CC=CC=C32)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC=C(C=C1)OCC2=CC=CC3=CC=CC=C32)/C#N

InChI

InChI=1S/C25H23NO2/c1-25(2,3)24(27)21(16-26)15-18-11-13-22(14-12-18)28-17-20-9-6-8-19-7-4-5-10-23(19)20/h4-15H,17H2,1-3H3/b21-15+