4-[3-(hydroxymethyl)piperidin-1-yl]sulfonyl-2-nitro-phenol

Systemtic Name: 4-[3-(hydroxymethyl)piperidin-1-yl]sulfonyl-2-nitro-phenol Openeye Name: 4-[[3-(hydroxymethyl)-1-piperidyl]sulfonyl]-2-nitro-phenol CAS Name: 4-[[3-(hydroxymethyl)-1-piperidinyl]sulfonyl]-2-nitrophenol IUPAC Name: 4-[3-(hydroxymethyl)piperidin-1-yl]sulfonyl-2-nitrophenol Traditional Name: 4-(3-methylolpiperidino)sulfonyl-2-nitro-phenol Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])CO

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])CO

InChI

InChI=1S/C12H16N2O6S/c15-8-9-2-1-5-13(7-9)21(19,20)10-3-4-12(16)11(6-10)14(17)18/h3-4,6,9,15-16H,1-2,5,7-8H2