3,4-dimethoxy-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C19H21F3N2O4S MolecularWeight: 430.44125

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21F3N2O4S/c1-27-17-8-6-14(12-18(17)28-2)29(25,26)23-15-11-13(19(20,21)22)5-7-16(15)24-9-3-4-10-24/h5-8,11-12,23H,3-4,9-10H2,1-2H3