4-bromanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)benzenesulfonamide Openeye Name: 4-bromo-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)benzenesulfonamide CAS Name: 4-bromo-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 4-bromo-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)benzenesulfonamide Formula: C18H21BrN2O5S2 MolecularWeight: 489.40374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)Br)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H21BrN2O5S2/c1-2-26-17-10-7-15(13-18(17)28(24,25)21-11-3-4-12-21)20-27(22,23)16-8-5-14(19)6-9-16/h5-10,13,20H,2-4,11-12H2,1H3