5-cyclopropyl-2-methylsulfonyl-3-(1,2-oxazol-4-yl)-4-(trifluoromethyl)benzaldehyde

Systemtic Name: 5-cyclopropyl-2-methylsulfonyl-3-(1,2-oxazol-4-yl)-4-(trifluoromethyl)benzaldehyde Openeye Name: 5-cyclopropyl-3-isoxazol-4-yl-2-methylsulfonyl-4-(trifluoromethyl)benzaldehyde CAS Name: 5-cyclopropyl-3-(4-isoxazolyl)-2-methylsulfonyl-4-(trifluoromethyl)benzaldehyde IUPAC Name: 5-cyclopropyl-2-methylsulfonyl-3-(1,2-oxazol-4-yl)-4-(trifluoromethyl)benzaldehyde Traditional Name: 5-cyclopropyl-3-isoxazol-4-yl-2-mesyl-4-(trifluoromethyl)benzaldehyde Formula: C15H12F3NO4S MolecularWeight: 359.32029

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=C(C=C1C=O)C2CC2)C(F)(F)F)C3=CON=C3

Isomeric SMILES

CS(=O)(=O)C1=C(C(=C(C=C1C=O)C2CC2)C(F)(F)F)C3=CON=C3

InChI

InChI=1S/C15H12F3NO4S/c1-24(21,22)14-9(6-20)4-11(8-2-3-8)13(15(16,17)18)12(14)10-5-19-23-7-10/h4-8H,2-3H2,1H3