4-[[4-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzoic acid

Systemtic Name: 4-[[4-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzoic acid Openeye Name: 4-[[4-(hydroxymethyl)-1-piperidyl]sulfonylmethyl]benzoic acid CAS Name: 4-[[4-(hydroxymethyl)-1-piperidinyl]sulfonylmethyl]benzoic acid IUPAC Name: 4-[[4-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzoic acid Traditional Name: 4-[(4-methylolpiperidino)sulfonylmethyl]benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)S(=O)(=O)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CN(CCC1CO)S(=O)(=O)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H19NO5S/c16-9-11-5-7-15(8-6-11)21(19,20)10-12-1-3-13(4-2-12)14(17)18/h1-4,11,16H,5-10H2,(H,17,18)