2-methoxy-5-thiomorpholin-4-ylsulfonyl-benzoate

Systemtic Name: 2-methoxy-5-thiomorpholin-4-ylsulfonyl-benzoate Openeye Name: 2-methoxy-5-thiomorpholinosulfonyl-benzoate CAS Name: 2-methoxy-5-thiomorpholin-4-ylsulfonylbenzoate IUPAC Name: 2-methoxy-5-thiomorpholin-4-ylsulfonylbenzoate Traditional Name: 2-methoxy-5-thiomorpholinosulfonyl-benzoate Formula: C12H14NO5S2- MolecularWeight: 316.37326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCSCC2)C(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCSCC2)C(=O)[O-]

InChI

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