4-methyl-4-oxidanyl-1-(4-phenylmethoxyphenyl)sulfonyl-piperidine-2-carboxylic acid

Systemtic Name: 4-methyl-4-oxidanyl-1-(4-phenylmethoxyphenyl)sulfonyl-piperidine-2-carboxylic acid Openeye Name: 1-(4-benzyloxyphenyl)sulfonyl-4-hydroxy-4-methyl-piperidine-2-carboxylic acid CAS Name: 4-hydroxy-4-methyl-1-(4-phenylmethoxyphenyl)sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 4-hydroxy-4-methyl-1-(4-phenylmethoxyphenyl)sulfonylpiperidine-2-carboxylic acid Traditional Name: 1-(4-benzoxyphenyl)sulfonyl-4-hydroxy-4-methyl-pipecolinic acid Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C(C1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

CC1(CCN(C(C1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C20H23NO6S/c1-20(24)11-12-21(18(13-20)19(22)23)28(25,26)17-9-7-16(8-10-17)27-14-15-5-3-2-4-6-15/h2-10,18,24H,11-14H2,1H3,(H,22,23)