N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-fluoranyl-4,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-fluoranyl-4,5-dimethoxy-benzenesulfonamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-fluoro-4,5-dimethoxy-benzenesulfonamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2-fluoro-4,5-dimethoxybenzenesulfonamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-fluoro-4,5-dimethoxybenzenesulfonamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-fluoro-4,5-dimethoxy-benzenesulfonamide Formula: C18H20ClFN2O6S2 MolecularWeight: 478.942603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)S(=O)(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)F

Isomeric SMILES

COC1=CC(=C(C=C1OC)S(=O)(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)F

InChI

InChI=1S/C18H20ClFN2O6S2/c1-27-15-10-14(20)18(11-16(15)28-2)29(23,24)21-12-5-6-13(19)17(9-12)30(25,26)22-7-3-4-8-22/h5-6,9-11,21H,3-4,7-8H2,1-2H3