4-(4-ethanoylpiperazin-1-yl)-5-fluoranyl-2-methyl-benzenecarbonitrile

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-5-fluoranyl-2-methyl-benzenecarbonitrile Openeye Name: 4-(4-acetylpiperazin-1-yl)-5-fluoro-2-methyl-benzonitrile CAS Name: 4-(4-acetyl-1-piperazinyl)-5-fluoro-2-methylbenzonitrile IUPAC Name: 4-(4-acetylpiperazin-1-yl)-5-fluoro-2-methylbenzonitrile Traditional Name: 4-(4-acetylpiperazino)-5-fluoro-2-methyl-benzonitrile Formula: C14H16FN3O MolecularWeight: 261.294743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16FN3O/c1-10-7-14(13(15)8-12(10)9-16)18-5-3-17(4-6-18)11(2)19/h7-8H,3-6H2,1-2H3