1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonyl-4-oxidanyl-piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonyl-4-oxidanyl-piperidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[4-(o-tolylmethoxy)phenyl]sulfonyl-piperidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonylpiperidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[4-(2-methylbenzyl)oxyphenyl]sulfonyl-pipecolinic acid Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1COC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3C(=O)O)O

InChI

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