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

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethyl)benzenesulfonamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-4-(trifluoromethyl)benzenesulfonamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-4-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-4-(trifluoromethyl)benzenesulfonamide Formula: C19H21F3N2O5S2 MolecularWeight: 478.50565

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21F3N2O5S2/c1-2-29-17-10-7-15(13-18(17)31(27,28)24-11-3-4-12-24)23-30(25,26)16-8-5-14(6-9-16)19(20,21)22/h5-10,13,23H,2-4,11-12H2,1H3