2,3-dihydro-1H-inden-5-yl-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1H-inden-5-yl-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: indan-5-yl-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: 2,3-dihydro-1H-inden-5-yl-[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1H-inden-5-yl-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: indan-5-yl-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C21H21F3N2O3S MolecularWeight: 438.46325

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H21F3N2O3S/c22-21(23,24)18-6-1-2-7-19(18)30(28,29)26-12-10-25(11-13-26)20(27)17-9-8-15-4-3-5-16(15)14-17/h1-2,6-9,14H,3-5,10-13H2