5-(2-bromanyl-5-methylsulfonyl-phenyl)-3-methyl-4,5-dihydro-1,2-oxazole

Systemtic Name: 5-(2-bromanyl-5-methylsulfonyl-phenyl)-3-methyl-4,5-dihydro-1,2-oxazole Openeye Name: 5-(2-bromo-5-methylsulfonyl-phenyl)-3-methyl-4,5-dihydroisoxazole CAS Name: 5-(2-bromo-5-methylsulfonylphenyl)-3-methyl-4,5-dihydroisoxazole IUPAC Name: 5-(2-bromo-5-methylsulfonylphenyl)-3-methyl-4,5-dihydro-1,2-oxazole Traditional Name: 5-(2-bromo-5-mesyl-phenyl)-3-methyl-2-isoxazoline Formula: C11H12BrNO3S MolecularWeight: 318.18688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(C1)C2=C(C=CC(=C2)S(=O)(=O)C)Br

Isomeric SMILES

CC1=NOC(C1)C2=C(C=CC(=C2)S(=O)(=O)C)Br

InChI

InChI=1S/C11H12BrNO3S/c1-7-5-11(16-13-7)9-6-8(17(2,14)15)3-4-10(9)12/h3-4,6,11H,5H2,1-2H3