2-[[3,4-bis(phenylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-[[3,4-bis(phenylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-[(3,4-dibenzyloxyphenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: 2-[[3,4-bis(phenylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: 2-[[3,4-bis(phenylmethoxy)phenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: 3-(3,4-dibenzoxyphenyl)-2-pivaloyl-acrylonitrile Formula: C28H27NO3 MolecularWeight: 425.51888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C28H27NO3/c1-28(2,3)27(30)24(18-29)16-23-14-15-25(31-19-21-10-6-4-7-11-21)26(17-23)32-20-22-12-8-5-9-13-22/h4-17H,19-20H2,1-3H3