1-[4-(dimethylamino)-3-nitro-phenyl]-3-(4-methylpiperazin-1-yl)propan-1-one

Systemtic Name: 1-[4-(dimethylamino)-3-nitro-phenyl]-3-(4-methylpiperazin-1-yl)propan-1-one Openeye Name: 1-[4-(dimethylamino)-3-nitro-phenyl]-3-(4-methylpiperazin-1-yl)propan-1-one CAS Name: 1-[4-(dimethylamino)-3-nitrophenyl]-3-(4-methyl-1-piperazinyl)-1-propanone IUPAC Name: 1-[4-(dimethylamino)-3-nitrophenyl]-3-(4-methylpiperazin-1-yl)propan-1-one Traditional Name: 1-[4-(dimethylamino)-3-nitro-phenyl]-3-(4-methylpiperazino)propan-1-one Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CCC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H24N4O3/c1-17(2)14-5-4-13(12-15(14)20(22)23)16(21)6-7-19-10-8-18(3)9-11-19/h4-5,12H,6-11H2,1-3H3