1-cyclopropyl-3-(4-methylsulfonyl-2-nitro-phenyl)-2-(5-methylsulfonyl-1,3,4-oxadiazol-2-yl)propane-1,3-dione

Systemtic Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitro-phenyl)-2-(5-methylsulfonyl-1,3,4-oxadiazol-2-yl)propane-1,3-dione Openeye Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitro-phenyl)-2-(5-methylsulfonyl-1,3,4-oxadiazol-2-yl)propane-1,3-dione CAS Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitrophenyl)-2-(5-methylsulfonyl-1,3,4-oxadiazol-2-yl)propane-1,3-dione IUPAC Name: 1-cyclopropyl-3-(4-methylsulfonyl-2-nitrophenyl)-2-(5-methylsulfonyl-1,3,4-oxadiazol-2-yl)propane-1,3-dione Traditional Name: 1-cyclopropyl-3-(4-mesyl-2-nitro-phenyl)-2-(5-mesyl-1,3,4-oxadiazol-2-yl)propane-1,3-dione Formula: C16H15N3O9S2 MolecularWeight: 457.435

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C(C2=NN=C(O2)S(=O)(=O)C)C(=O)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C(C2=NN=C(O2)S(=O)(=O)C)C(=O)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O9S2/c1-29(24,25)9-5-6-10(11(7-9)19(22)23)14(21)12(13(20)8-3-4-8)15-17-18-16(28-15)30(2,26)27/h5-8,12H,3-4H2,1-2H3