(4-bromanyl-2-methylsulfonyl-phenyl)carbonyl 5-cyclopropyl-1,2-oxazole-3-carboxylate

Systemtic Name: (4-bromanyl-2-methylsulfonyl-phenyl)carbonyl 5-cyclopropyl-1,2-oxazole-3-carboxylate Openeye Name: (4-bromo-2-methylsulfonyl-benzoyl) 5-cyclopropylisoxazole-3-carboxylate CAS Name: 5-cyclopropyl-3-isoxazolecarboxylic acid [(4-bromo-2-methylsulfonylphenyl)-oxomethyl] ester IUPAC Name: (4-bromo-2-methylsulfonylbenzoyl) 5-cyclopropyl-1,2-oxazole-3-carboxylate Traditional Name: 5-cyclopropylisoxazole-3-carboxylic acid (4-bromo-2-mesyl-benzoyl) ester Formula: C15H12BrNO6S MolecularWeight: 414.22788

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)Br)C(=O)OC(=O)C2=NOC(=C2)C3CC3

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)Br)C(=O)OC(=O)C2=NOC(=C2)C3CC3

InChI

InChI=1S/C15H12BrNO6S/c1-24(20,21)13-6-9(16)4-5-10(13)14(18)22-15(19)11-7-12(23-17-11)8-2-3-8/h4-8H,2-3H2,1H3