2-(hydroxymethyl)-3-methyl-1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonyl-piperidin-3-ol

Systemtic Name: 2-(hydroxymethyl)-3-methyl-1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonyl-piperidin-3-ol Openeye Name: 2-(hydroxymethyl)-3-methyl-1-[4-(o-tolylmethoxy)phenyl]sulfonyl-piperidin-3-ol CAS Name: 2-(hydroxymethyl)-3-methyl-1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonyl-3-piperidinol IUPAC Name: 2-(hydroxymethyl)-3-methyl-1-[4-[(2-methylphenyl)methoxy]phenyl]sulfonylpiperidin-3-ol Traditional Name: 3-methyl-1-[4-(2-methylbenzyl)oxyphenyl]sulfonyl-2-methylol-piperidin-3-ol Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3CO)(C)O

Isomeric SMILES

CC1=CC=CC=C1COC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3CO)(C)O

InChI

InChI=1S/C21H27NO5S/c1-16-6-3-4-7-17(16)15-27-18-8-10-19(11-9-18)28(25,26)22-13-5-12-21(2,24)20(22)14-23/h3-4,6-11,20,23-24H,5,12-15H2,1-2H3