(2E)-4,4-dimethyl-3-oxidanylidene-2-(quinoxalin-2-ylmethylidene)pentanenitrile

Systemtic Name: (2E)-4,4-dimethyl-3-oxidanylidene-2-(quinoxalin-2-ylmethylidene)pentanenitrile Openeye Name: (2E)-4,4-dimethyl-3-oxo-2-(quinoxalin-2-ylmethylene)pentanenitrile CAS Name: (2E)-4,4-dimethyl-3-oxo-2-(2-quinoxalinylmethylidene)pentanenitrile IUPAC Name: (2E)-4,4-dimethyl-3-oxo-2-(quinoxalin-2-ylmethylidene)pentanenitrile Traditional Name: (E)-2-pivaloyl-3-quinoxalin-2-yl-acrylonitrile Formula: C16H15N3O MolecularWeight: 265.3098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=NC2=CC=CC=C2N=C1)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=NC2=CC=CC=C2N=C1)/C#N

InChI

InChI=1S/C16H15N3O/c1-16(2,3)15(20)11(9-17)8-12-10-18-13-6-4-5-7-14(13)19-12/h4-8,10H,1-3H3/b11-8+