3-methyl-5-oxidanyl-1-[4-[(2-propan-2-ylphenyl)methoxy]phenyl]sulfonyl-piperidine-2-carboxylic acid

Systemtic Name: 3-methyl-5-oxidanyl-1-[4-[(2-propan-2-ylphenyl)methoxy]phenyl]sulfonyl-piperidine-2-carboxylic acid Openeye Name: 5-hydroxy-1-[4-[(2-isopropylphenyl)methoxy]phenyl]sulfonyl-3-methyl-piperidine-2-carboxylic acid CAS Name: 5-hydroxy-3-methyl-1-[4-[(2-propan-2-ylphenyl)methoxy]phenyl]sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 5-hydroxy-3-methyl-1-[4-[(2-propan-2-ylphenyl)methoxy]phenyl]sulfonylpiperidine-2-carboxylic acid Traditional Name: 5-hydroxy-1-[4-(2-isopropylbenzyl)oxyphenyl]sulfonyl-3-methyl-pipecolinic acid Formula: C23H29NO6S MolecularWeight: 447.54446

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3C(C)C)O

Isomeric SMILES

CC1CC(CN(C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3C(C)C)O

InChI

InChI=1S/C23H29NO6S/c1-15(2)21-7-5-4-6-17(21)14-30-19-8-10-20(11-9-19)31(28,29)24-13-18(25)12-16(3)22(24)23(26)27/h4-11,15-16,18,22,25H,12-14H2,1-3H3,(H,26,27)