5-(3-bromanyl-2-methyl-6-methylsulfonyl-phenyl)-3-methyl-4,5-dihydro-1,2-oxazole

Systemtic Name: 5-(3-bromanyl-2-methyl-6-methylsulfonyl-phenyl)-3-methyl-4,5-dihydro-1,2-oxazole Openeye Name: 5-(3-bromo-2-methyl-6-methylsulfonyl-phenyl)-3-methyl-4,5-dihydroisoxazole CAS Name: 5-(3-bromo-2-methyl-6-methylsulfonylphenyl)-3-methyl-4,5-dihydroisoxazole IUPAC Name: 5-(3-bromo-2-methyl-6-methylsulfonylphenyl)-3-methyl-4,5-dihydro-1,2-oxazole Traditional Name: 5-(3-bromo-6-mesyl-2-methyl-phenyl)-3-methyl-2-isoxazoline Formula: C12H14BrNO3S MolecularWeight: 332.21346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(C1)C2=C(C=CC(=C2C)Br)S(=O)(=O)C

Isomeric SMILES

CC1=NOC(C1)C2=C(C=CC(=C2C)Br)S(=O)(=O)C

InChI

InChI=1S/C12H14BrNO3S/c1-7-6-10(17-14-7)12-8(2)9(13)4-5-11(12)18(3,15)16/h4-5,10H,6H2,1-3H3