ethyl 4-[[4-[(2-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate

Systemtic Name: ethyl 4-[[4-[(2-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate Openeye Name: ethyl 4-[[4-[(2-chlorobenzoyl)amino]-3-fluoro-phenyl]sulfonylamino]benzoate CAS Name: 4-[[4-[[(2-chlorophenyl)-oxomethyl]amino]-3-fluorophenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[(2-chlorobenzoyl)amino]-3-fluorophenyl]sulfonylamino]benzoate Traditional Name: 4-[[4-[(2-chlorobenzoyl)amino]-3-fluoro-phenyl]sulfonylamino]benzoic acid ethyl ester Formula: C22H18ClFN2O5S MolecularWeight: 476.905123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)F

InChI

InChI=1S/C22H18ClFN2O5S/c1-2-31-22(28)14-7-9-15(10-8-14)26-32(29,30)16-11-12-20(19(24)13-16)25-21(27)17-5-3-4-6-18(17)23/h3-13,26H,2H2,1H3,(H,25,27)