(3-nitrophenyl) 4-chloranyl-3-[(4-fluorophenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: (3-nitrophenyl) 4-chloranyl-3-[(4-fluorophenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: (3-nitrophenyl) 3-[allyl-(4-fluorophenyl)sulfamoyl]-4-chloro-benzoate CAS Name: 4-chloro-3-[(4-fluorophenyl)-prop-2-enylsulfamoyl]benzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 4-chloro-3-[(4-fluorophenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 3-[allyl-(4-fluorophenyl)sulfamoyl]-4-chloro-benzoic acid (3-nitrophenyl) ester Formula: C22H16ClFN2O6S MolecularWeight: 490.888643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=C(C=C1)F)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCN(C1=CC=C(C=C1)F)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H16ClFN2O6S/c1-2-12-25(17-9-7-16(24)8-10-17)33(30,31)21-13-15(6-11-20(21)23)22(27)32-19-5-3-4-18(14-19)26(28)29/h2-11,13-14H,1,12H2