1-(3-chloranyl-4-fluoranyl-phenyl)-4-(3,3-dimethylbutanoyl)-3-methyl-piperazin-2-one

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-4-(3,3-dimethylbutanoyl)-3-methyl-piperazin-2-one Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-4-(3,3-dimethylbutanoyl)-3-methyl-piperazin-2-one CAS Name: 1-(3-chloro-4-fluorophenyl)-4-(3,3-dimethyl-1-oxobutyl)-3-methyl-2-piperazinone IUPAC Name: 1-(3-chloro-4-fluorophenyl)-4-(3,3-dimethylbutanoyl)-3-methylpiperazin-2-one Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-4-(3,3-dimethylbutanoyl)-3-methyl-piperazin-2-one Formula: C17H22ClFN2O2 MolecularWeight: 340.820183

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCN1C(=O)CC(C)(C)C)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC1C(=O)N(CCN1C(=O)CC(C)(C)C)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C17H22ClFN2O2/c1-11-16(23)21(12-5-6-14(19)13(18)9-12)8-7-20(11)15(22)10-17(2,3)4/h5-6,9,11H,7-8,10H2,1-4H3