5-bromanyl-2-fluoranyl-3-thiomorpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 5-bromanyl-2-fluoranyl-3-thiomorpholin-4-ylsulfonyl-benzoic acid Openeye Name: 5-bromo-2-fluoro-3-thiomorpholinosulfonyl-benzoic acid CAS Name: 5-bromo-2-fluoro-3-thiomorpholin-4-ylsulfonylbenzoic acid IUPAC Name: 5-bromo-2-fluoro-3-thiomorpholin-4-ylsulfonylbenzoic acid Traditional Name: 5-bromo-2-fluoro-3-thiomorpholinosulfonyl-benzoic acid Formula: C11H11BrFNO4S2 MolecularWeight: 384.241743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1S(=O)(=O)C2=C(C(=CC(=C2)Br)C(=O)O)F

Isomeric SMILES

C1CSCCN1S(=O)(=O)C2=C(C(=CC(=C2)Br)C(=O)O)F

InChI

InChI=1S/C11H11BrFNO4S2/c12-7-5-8(11(15)16)10(13)9(6-7)20(17,18)14-1-3-19-4-2-14/h5-6H,1-4H2,(H,15,16)