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

Systemtic Name: 4-(3,3-dimethylbutanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one Openeye Name: 4-(3,3-dimethylbutanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one CAS Name: 4-(3,3-dimethyl-1-oxobutyl)-3-methyl-1-(4-nitrophenyl)-2-piperazinone IUPAC Name: 4-(3,3-dimethylbutanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one Traditional Name: 4-(3,3-dimethylbutanoyl)-3-methyl-1-(4-nitrophenyl)piperazin-2-one Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CCN1C(=O)CC(C)(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1C(=O)N(CCN1C(=O)CC(C)(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O4/c1-12-16(22)19(13-5-7-14(8-6-13)20(23)24)10-9-18(12)15(21)11-17(2,3)4/h5-8,12H,9-11H2,1-4H3