1-(5-bromanyl-2-methyl-phenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(5-bromanyl-2-methyl-phenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(5-bromo-2-methyl-phenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-(5-bromo-2-methylphenyl)sulfonyl-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(5-bromo-2-methylphenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-(5-bromo-2-methyl-phenyl)sulfonyl-4-hydroxy-proline Formula: C12H14BrNO5S MolecularWeight: 364.21226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C12H14BrNO5S/c1-7-2-3-8(13)4-11(7)20(18,19)14-6-9(15)5-10(14)12(16)17/h2-4,9-10,15H,5-6H2,1H3,(H,16,17)