3-[4-(4-fluorophenyl)phenyl]sulfonyl-2,4-dimethyl-thiomorpholine-2-carboxylic acid

Systemtic Name: 3-[4-(4-fluorophenyl)phenyl]sulfonyl-2,4-dimethyl-thiomorpholine-2-carboxylic acid Openeye Name: 3-[4-(4-fluorophenyl)phenyl]sulfonyl-2,4-dimethyl-thiomorpholine-2-carboxylic acid CAS Name: 3-[4-(4-fluorophenyl)phenyl]sulfonyl-2,4-dimethyl-2-thiomorpholinecarboxylic acid IUPAC Name: 3-[4-(4-fluorophenyl)phenyl]sulfonyl-2,4-dimethylthiomorpholine-2-carboxylic acid Traditional Name: 3-[4-(4-fluorophenyl)phenyl]sulfonyl-2,4-dimethyl-thiomorpholine-2-carboxylic acid Formula: C19H20FNO4S2 MolecularWeight: 409.494803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)C)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)F)C(=O)O

Isomeric SMILES

CC1(C(N(CCS1)C)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)F)C(=O)O

InChI

InChI=1S/C19H20FNO4S2/c1-19(18(22)23)17(21(2)11-12-26-19)27(24,25)16-9-5-14(6-10-16)13-3-7-15(20)8-4-13/h3-10,17H,11-12H2,1-2H3,(H,22,23)