1-[4-[[2,5-bis(bromanyl)phenyl]methoxy]phenyl]sulfonyl-5-oxidanyl-piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[[2,5-bis(bromanyl)phenyl]methoxy]phenyl]sulfonyl-5-oxidanyl-piperidine-2-carboxylic acid Openeye Name: 1-[4-[(2,5-dibromophenyl)methoxy]phenyl]sulfonyl-5-hydroxy-piperidine-2-carboxylic acid CAS Name: 1-[4-[(2,5-dibromophenyl)methoxy]phenyl]sulfonyl-5-hydroxy-2-piperidinecarboxylic acid IUPAC Name: 1-[4-[(2,5-dibromophenyl)methoxy]phenyl]sulfonyl-5-hydroxypiperidine-2-carboxylic acid Traditional Name: 1-[4-(2,5-dibromobenzyl)oxyphenyl]sulfonyl-5-hydroxy-pipecolinic acid Formula: C19H19Br2NO6S MolecularWeight: 549.23026

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(CC1O)S(=O)(=O)C2=CC=C(C=C2)OCC3=C(C=CC(=C3)Br)Br)C(=O)O

Isomeric SMILES

C1CC(N(CC1O)S(=O)(=O)C2=CC=C(C=C2)OCC3=C(C=CC(=C3)Br)Br)C(=O)O

InChI

InChI=1S/C19H19Br2NO6S/c20-13-1-7-17(21)12(9-13)11-28-15-3-5-16(6-4-15)29(26,27)22-10-14(23)2-8-18(22)19(24)25/h1,3-7,9,14,18,23H,2,8,10-11H2,(H,24,25)