(2S)-1-(4-phenylpiperazin-1-ium-1-yl)-3-prop-2-enoxy-propan-2-ol

Systemtic Name: (2S)-1-(4-phenylpiperazin-1-ium-1-yl)-3-prop-2-enoxy-propan-2-ol Openeye Name: (2S)-1-allyloxy-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(4-phenyl-1-piperazin-1-iumyl)-3-prop-2-enoxy-2-propanol IUPAC Name: (2S)-1-(4-phenylpiperazin-1-ium-1-yl)-3-prop-2-enoxypropan-2-ol Traditional Name: (2S)-1-allyloxy-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Formula: C16H25N2O2+ MolecularWeight: 277.3819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2/c1-2-12-20-14-16(19)13-17-8-10-18(11-9-17)15-6-4-3-5-7-15/h2-7,16,19H,1,8-14H2/p+1/t16-/m0/s1