1-cyclopropyl-3-(4-methylsulfonyl-2-nitro-phenyl)-2-pyridazin-3-yl-propane-1,3-dione

Systemtic Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitro-phenyl)-2-pyridazin-3-yl-propane-1,3-dione Openeye Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitro-phenyl)-2-pyridazin-3-yl-propane-1,3-dione CAS Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitrophenyl)-2-(3-pyridazinyl)propane-1,3-dione IUPAC Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitrophenyl)-2-pyridazin-3-ylpropane-1,3-dione Traditional Name: 1-cyclopropyl-3-(4-mesyl-2-nitro-phenyl)-2-pyridazin-3-yl-propane-1,3-dione Formula: C17H15N3O6S MolecularWeight: 389.3825

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C(C2=NN=CC=C2)C(=O)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C(C2=NN=CC=C2)C(=O)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O6S/c1-27(25,26)11-6-7-12(14(9-11)20(23)24)17(22)15(16(21)10-4-5-10)13-3-2-8-18-19-13/h2-3,6-10,15H,4-5H2,1H3