(2S)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenoxy-propan-2-ol

Systemtic Name: (2S)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenoxy-propan-2-ol Openeye Name: (2S)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenoxy-propan-2-ol CAS Name: (2S)-1-(4-methyl-1-piperazin-4-iumyl)-3-phenoxy-2-propanol IUPAC Name: (2S)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenoxypropan-2-ol Traditional Name: (2S)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenoxy-propan-2-ol Formula: C14H23N2O2+ MolecularWeight: 251.34462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O2/c1-15-7-9-16(10-8-15)11-13(17)12-18-14-5-3-2-4-6-14/h2-6,13,17H,7-12H2,1H3/p+1/t13-/m0/s1