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

Systemtic Name: (2E)-4,4-dimethyl-3-oxidanylidene-2-[(quinolin-8-ylamino)methylidene]pentanenitrile Openeye Name: (2E)-4,4-dimethyl-3-oxo-2-[(8-quinolylamino)methylene]pentanenitrile CAS Name: (2E)-4,4-dimethyl-3-oxo-2-[(8-quinolinylamino)methylidene]pentanenitrile IUPAC Name: (2E)-4,4-dimethyl-3-oxo-2-[(quinolin-8-ylamino)methylidene]pentanenitrile Traditional Name: (E)-2-pivaloyl-3-(8-quinolylamino)acrylonitrile Formula: C17H17N3O MolecularWeight: 279.33638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CNC1=CC=CC2=C1N=CC=C2)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/NC1=CC=CC2=C1N=CC=C2)/C#N

InChI

InChI=1S/C17H17N3O/c1-17(2,3)16(21)13(10-18)11-20-14-8-4-6-12-7-5-9-19-15(12)14/h4-9,11,20H,1-3H3/b13-11+