N-(4-bromanyl-2-fluoranyl-phenyl)-4-methoxy-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-methoxy-3-pyrrolidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-(4-bromo-2-fluorophenyl)-4-methoxy-3-[oxo(1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-4-methoxy-3-(pyrrolidine-1-carbonyl)benzenesulfonamide Formula: C18H18BrFN2O4S MolecularWeight: 457.313923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)F)C(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)F)C(=O)N3CCCC3

InChI

InChI=1S/C18H18BrFN2O4S/c1-26-17-7-5-13(11-14(17)18(23)22-8-2-3-9-22)27(24,25)21-16-6-4-12(19)10-15(16)20/h4-7,10-11,21H,2-3,8-9H2,1H3