5-bromanyl-1-(4-methylphenyl)sulfonyl-4-oxidanyl-piperidine-2-carboxylic acid

Systemtic Name: 5-bromanyl-1-(4-methylphenyl)sulfonyl-4-oxidanyl-piperidine-2-carboxylic acid Openeye Name: 5-bromo-4-hydroxy-1-(p-tolylsulfonyl)piperidine-2-carboxylic acid CAS Name: 5-bromo-4-hydroxy-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 5-bromo-4-hydroxy-1-(4-methylphenyl)sulfonylpiperidine-2-carboxylic acid Traditional Name: 5-bromo-4-hydroxy-1-tosyl-pipecolinic acid Formula: C13H16BrNO5S MolecularWeight: 378.23884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrNO5S/c1-8-2-4-9(5-3-8)21(19,20)15-7-10(14)12(16)6-11(15)13(17)18/h2-5,10-12,16H,6-7H2,1H3,(H,17,18)