1-[4-[(2,4-dichlorophenyl)methoxy]phenyl]sulfonyl-3,3-dimethyl-5-oxidanyl-piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[(2,4-dichlorophenyl)methoxy]phenyl]sulfonyl-3,3-dimethyl-5-oxidanyl-piperidine-2-carboxylic acid Openeye Name: 1-[4-[(2,4-dichlorophenyl)methoxy]phenyl]sulfonyl-5-hydroxy-3,3-dimethyl-piperidine-2-carboxylic acid CAS Name: 1-[4-[(2,4-dichlorophenyl)methoxy]phenyl]sulfonyl-5-hydroxy-3,3-dimethyl-2-piperidinecarboxylic acid IUPAC Name: 1-[4-[(2,4-dichlorophenyl)methoxy]phenyl]sulfonyl-5-hydroxy-3,3-dimethylpiperidine-2-carboxylic acid Traditional Name: 1-[4-(2,4-dichlorobenzyl)oxyphenyl]sulfonyl-5-hydroxy-3,3-dimethyl-pipecolinic acid Formula: C21H23Cl2NO6S MolecularWeight: 488.38142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CN(C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=C(C=C(C=C3)Cl)Cl)O)C

Isomeric SMILES

CC1(CC(CN(C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=C(C=C(C=C3)Cl)Cl)O)C

InChI

InChI=1S/C21H23Cl2NO6S/c1-21(2)10-15(25)11-24(19(21)20(26)27)31(28,29)17-7-5-16(6-8-17)30-12-13-3-4-14(22)9-18(13)23/h3-9,15,19,25H,10-12H2,1-2H3,(H,26,27)