N-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[4-(4-caprylylpiperazino)phenyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C25H32F3N3O3S MolecularWeight: 511.60009

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C25H32F3N3O3S/c1-2-3-4-5-6-10-24(32)31-17-15-30(16-18-31)22-13-11-21(12-14-22)29-35(33,34)23-9-7-8-20(19-23)25(26,27)28/h7-9,11-14,19,29H,2-6,10,15-18H2,1H3