(2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-indan-5-yloxy-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-(4-methyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2R)-1-(2,3-dihydro-1H-inden-5-yloxy)-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-indan-5-yloxy-3-(4-methylpiperazin-4-ium-1-yl)propan-2-ol Formula: C17H27N2O2+ MolecularWeight: 291.40848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(COC2=CC3=C(CCC3)C=C2)O

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@H](COC2=CC3=C(CCC3)C=C2)O

InChI

InChI=1S/C17H26N2O2/c1-18-7-9-19(10-8-18)12-16(20)13-21-17-6-5-14-3-2-4-15(14)11-17/h5-6,11,16,20H,2-4,7-10,12-13H2,1H3/p+1/t16-/m1/s1