(2Z)-4,4-dimethyl-3-oxidanylidene-2-[(4-phenylpiperazin-1-yl)methylidene]pentanenitrile

Systemtic Name: (2Z)-4,4-dimethyl-3-oxidanylidene-2-[(4-phenylpiperazin-1-yl)methylidene]pentanenitrile Openeye Name: (2Z)-4,4-dimethyl-3-oxo-2-[(4-phenylpiperazin-1-yl)methylene]pentanenitrile CAS Name: (2Z)-4,4-dimethyl-3-oxo-2-[(4-phenyl-1-piperazinyl)methylidene]pentanenitrile IUPAC Name: (2Z)-4,4-dimethyl-3-oxo-2-[(4-phenylpiperazin-1-yl)methylidene]pentanenitrile Traditional Name: (Z)-3-(4-phenylpiperazino)-2-pivaloyl-acrylonitrile Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CN1CCN(CC1)C2=CC=CC=C2)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C\N1CCN(CC1)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C18H23N3O/c1-18(2,3)17(22)15(13-19)14-20-9-11-21(12-10-20)16-7-5-4-6-8-16/h4-8,14H,9-12H2,1-3H3/b15-14-