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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-4-(3,3-dimethylbutanoyl)-3-methyl-piperazin-2-one Openeye Name: 1-(3-chloro-4-methyl-phenyl)-4-(3,3-dimethylbutanoyl)-3-methyl-piperazin-2-one CAS Name: 1-(3-chloro-4-methylphenyl)-4-(3,3-dimethyl-1-oxobutyl)-3-methyl-2-piperazinone IUPAC Name: 1-(3-chloro-4-methylphenyl)-4-(3,3-dimethylbutanoyl)-3-methylpiperazin-2-one Traditional Name: 1-(3-chloro-4-methyl-phenyl)-4-(3,3-dimethylbutanoyl)-3-methyl-piperazin-2-one Formula: C18H25ClN2O2 MolecularWeight: 336.8563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN2O2/c1-12-6-7-14(10-15(12)19)21-9-8-20(13(2)17(21)23)16(22)11-18(3,4)5/h6-7,10,13H,8-9,11H2,1-5H3