5-[3-(hydroxymethyl)piperidin-1-yl]sulfonyl-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[3-(hydroxymethyl)piperidin-1-yl]sulfonyl-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[[3-(hydroxymethyl)-1-piperidyl]sulfonyl]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[3-(hydroxymethyl)-1-piperidinyl]sulfonyl]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[3-(hydroxymethyl)piperidin-1-yl]sulfonyl-3-methylthiophene-2-carboxylic acid Traditional Name: 3-methyl-5-(3-methylolpiperidino)sulfonyl-2-thenoic acid Formula: C12H17NO5S2 MolecularWeight: 319.39708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)S(=O)(=O)N2CCCC(C2)CO)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)S(=O)(=O)N2CCCC(C2)CO)C(=O)O

InChI

InChI=1S/C12H17NO5S2/c1-8-5-10(19-11(8)12(15)16)20(17,18)13-4-2-3-9(6-13)7-14/h5,9,14H,2-4,6-7H2,1H3,(H,15,16)