2-[4-[4-(hydroxymethyl)piperidin-1-yl]sulfonylphenyl]ethanoic acid

Systemtic Name: 2-[4-[4-(hydroxymethyl)piperidin-1-yl]sulfonylphenyl]ethanoic acid Openeye Name: 2-[4-[[4-(hydroxymethyl)-1-piperidyl]sulfonyl]phenyl]acetic acid CAS Name: 2-[4-[[4-(hydroxymethyl)-1-piperidinyl]sulfonyl]phenyl]acetic acid IUPAC Name: 2-[4-[4-(hydroxymethyl)piperidin-1-yl]sulfonylphenyl]acetic acid Traditional Name: 2-[4-(4-methylolpiperidino)sulfonylphenyl]acetic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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