4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile

Systemtic Name: 4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-5-fluoranyl-2-methyl-benzenecarbonitrile Openeye Name: 4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-5-fluoro-2-methyl-benzonitrile CAS Name: 4-[4-(2,2-dimethyl-1-oxopropyl)-1-piperazinyl]-5-fluoro-2-methylbenzonitrile IUPAC Name: 4-[4-(2,2-dimethylpropanoyl)piperazin-1-yl]-5-fluoro-2-methylbenzonitrile Traditional Name: 5-fluoro-2-methyl-4-(4-pivaloylpiperazino)benzonitrile Formula: C17H22FN3O MolecularWeight: 303.374483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C#N)F)N2CCN(CC2)C(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C#N)F)N2CCN(CC2)C(=O)C(C)(C)C

InChI

InChI=1S/C17H22FN3O/c1-12-9-15(14(18)10-13(12)11-19)20-5-7-21(8-6-20)16(22)17(2,3)4/h9-10H,5-8H2,1-4H3