N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C17H16ClF3N2O4S2 MolecularWeight: 468.89815

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H16ClF3N2O4S2/c18-16-8-3-12(11-15(16)17(19,20)21)22-28(24,25)13-4-6-14(7-5-13)29(26,27)23-9-1-2-10-23/h3-8,11,22H,1-2,9-10H2