oxidanyl-[1-(phenylmethyl)piperidin-2-yl]methanesulfonic acid

Systemtic Name: oxidanyl-[1-(phenylmethyl)piperidin-2-yl]methanesulfonic acid Openeye Name: (1-benzyl-2-piperidyl)-hydroxy-methanesulfonic acid CAS Name: hydroxy-[1-(phenylmethyl)-2-piperidinyl]methanesulfonic acid IUPAC Name: (1-benzylpiperidin-2-yl)-hydroxymethanesulfonic acid Traditional Name: (1-benzyl-2-piperidyl)-hydroxy-methanesulfonic acid Formula: C13H19NO4S MolecularWeight: 285.35926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(O)S(=O)(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1CCN(C(C1)C(O)S(=O)(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C13H19NO4S/c15-13(19(16,17)18)12-8-4-5-9-14(12)10-11-6-2-1-3-7-11/h1-3,6-7,12-13,15H,4-5,8-10H2,(H,16,17,18)