2-methyl-1-[4-[2-(methylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[2-(methylamino)-5-nitro-phenyl]carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[2-(methylamino)-5-nitro-benzoyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[[2-(methylamino)-5-nitrophenyl]-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-[2-(methylamino)-5-nitrobenzoyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[2-(methylamino)-5-nitro-benzoyl]piperazino]propan-1-one Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC

InChI

InChI=1S/C16H22N4O4/c1-11(2)15(21)18-6-8-19(9-7-18)16(22)13-10-12(20(23)24)4-5-14(13)17-3/h4-5,10-11,17H,6-9H2,1-3H3