3-fluoranyl-4-methoxy-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-methoxy-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzenesulfonamide Openeye Name: 3-fluoro-4-methoxy-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)benzenesulfonamide CAS Name: 3-fluoro-4-methoxy-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 3-fluoro-4-methoxy-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 3-fluoro-4-methoxy-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)benzenesulfonamide Formula: C18H21FN2O6S2 MolecularWeight: 444.497543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NS(=O)(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NS(=O)(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C18H21FN2O6S2/c1-26-17-7-5-13(11-15(17)19)28(22,23)20-16-12-14(6-8-18(16)27-2)29(24,25)21-9-3-4-10-21/h5-8,11-12,20H,3-4,9-10H2,1-2H3