4-(4-methoxyphenyl)sulfonylthiomorpholine-3-carboxylic acid

Systemtic Name: 4-(4-methoxyphenyl)sulfonylthiomorpholine-3-carboxylic acid Openeye Name: 4-(4-methoxyphenyl)sulfonylthiomorpholine-3-carboxylic acid CAS Name: 4-(4-methoxyphenyl)sulfonyl-3-thiomorpholinecarboxylic acid IUPAC Name: 4-(4-methoxyphenyl)sulfonylthiomorpholine-3-carboxylic acid Traditional Name: 4-(4-methoxyphenyl)sulfonylthiomorpholine-3-carboxylic acid Formula: C12H15NO5S2 MolecularWeight: 317.3812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCSCC2C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCSCC2C(=O)O

InChI

InChI=1S/C12H15NO5S2/c1-18-9-2-4-10(5-3-9)20(16,17)13-6-7-19-8-11(13)12(14)15/h2-5,11H,6-8H2,1H3,(H,14,15)