3-[(2S)-1-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpyrrolidin-2-yl]-5-methyl-1,2-oxazole

Systemtic Name: 3-[(2S)-1-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpyrrolidin-2-yl]-5-methyl-1,2-oxazole Openeye Name: 3-[(2S)-1-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpyrrolidin-2-yl]-5-methyl-isoxazole CAS Name: 3-[(2S)-1-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-2-pyrrolidinyl]-5-methylisoxazole IUPAC Name: 3-[(2S)-1-(2-bromo-4,5-dimethoxyphenyl)sulfonylpyrrolidin-2-yl]-5-methyl-1,2-oxazole Traditional Name: 3-[(2S)-1-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpyrrolidin-2-yl]-5-methyl-isoxazole Formula: C16H19BrN2O5S MolecularWeight: 431.30146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C2CCCN2S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

Isomeric SMILES

CC1=CC(=NO1)[C@@H]2CCCN2S(=O)(=O)C3=C(C=C(C(=C3)OC)OC)Br

InChI

InChI=1S/C16H19BrN2O5S/c1-10-7-12(18-24-10)13-5-4-6-19(13)25(20,21)16-9-15(23-3)14(22-2)8-11(16)17/h7-9,13H,4-6H2,1-3H3/t13-/m0/s1