6-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2,3-dihydro-1H-inden-5-ol

Systemtic Name: 6-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2,3-dihydro-1H-inden-5-ol Openeye Name: 6-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]indan-5-ol CAS Name: 6-[[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2,3-dihydro-1H-inden-5-ol IUPAC Name: 6-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2,3-dihydro-1H-inden-5-ol Traditional Name: 6-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]indan-5-ol Formula: C20H24FN2O3S+ MolecularWeight: 391.479563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=C(C=C2C1)O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CC2=CC(=C(C=C2C1)O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C20H23FN2O3S/c21-18-5-2-6-19(13-18)27(25,26)23-9-7-22(8-10-23)14-17-11-15-3-1-4-16(15)12-20(17)24/h2,5-6,11-13,24H,1,3-4,7-10,14H2/p+1