(4R,5S)-1-(4-methylphenyl)sulfonylazepane-4,5-diol

Systemtic Name: (4R,5S)-1-(4-methylphenyl)sulfonylazepane-4,5-diol Openeye Name: (4R,5S)-1-(p-tolylsulfonyl)azepane-4,5-diol CAS Name: (4R,5S)-1-(4-methylphenyl)sulfonylazepane-4,5-diol IUPAC Name: (4R,5S)-1-(4-methylphenyl)sulfonylazepane-4,5-diol Traditional Name: (4R,5S)-1-tosylazepane-4,5-diol Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(C(CC2)O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC[C@H]([C@H](CC2)O)O

InChI

InChI=1S/C13H19NO4S/c1-10-2-4-11(5-3-10)19(17,18)14-8-6-12(15)13(16)7-9-14/h2-5,12-13,15-16H,6-9H2,1H3/t12-,13+