(2E)-2-[[4-methoxy-3-(quinolin-8-yloxymethyl)phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[[4-methoxy-3-(quinolin-8-yloxymethyl)phenyl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[[4-methoxy-3-(8-quinolyloxymethyl)phenyl]methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[[4-methoxy-3-(8-quinolinyloxymethyl)phenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[[4-methoxy-3-(quinolin-8-yloxymethyl)phenyl]methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-[4-methoxy-3-(8-quinolyloxymethyl)phenyl]-2-pivaloyl-acrylonitrile Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1)OC)COC2=CC=CC3=C2N=CC=C3)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC(=C(C=C1)OC)COC2=CC=CC3=C2N=CC=C3)/C#N

InChI

InChI=1S/C25H24N2O3/c1-25(2,3)24(28)19(15-26)13-17-10-11-21(29-4)20(14-17)16-30-22-9-5-7-18-8-6-12-27-23(18)22/h5-14H,16H2,1-4H3/b19-13+