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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CO)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O6S/c15-8-9-3-5-13(6-4-9)21(19,20)10-1-2-12(16)11(7-10)14(17)18/h1-2,7,9,15-16H,3-6,8H2