2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-1-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)propane-1,3-dione

Systemtic Name: 2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-1-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)propane-1,3-dione Openeye Name: 2-(5-bromo-2-oxo-1-pyridyl)-1-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)propane-1,3-dione CAS Name: 2-(5-bromo-2-oxo-1-pyridinyl)-1-(4-methyl-1-piperazinyl)-3-(4-nitrophenyl)propane-1,3-dione IUPAC Name: 2-(5-bromo-2-oxopyridin-1-yl)-1-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)propane-1,3-dione Traditional Name: 2-(5-bromo-2-keto-1-pyridyl)-1-(4-methylpiperazino)-3-(4-nitrophenyl)propane-1,3-dione Formula: C19H19BrN4O5 MolecularWeight: 463.28196

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N3C=C(C=CC3=O)Br

Isomeric SMILES

CN1CCN(CC1)C(=O)C(C(=O)C2=CC=C(C=C2)[N+](=O)[O-])N3C=C(C=CC3=O)Br

InChI

InChI=1S/C19H19BrN4O5/c1-21-8-10-22(11-9-21)19(27)17(23-12-14(20)4-7-16(23)25)18(26)13-2-5-15(6-3-13)24(28)29/h2-7,12,17H,8-11H2,1H3