(2S)-1-piperazin-4-ium-1-yl-3-(2-prop-2-enylphenoxy)propan-2-ol

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

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(CN2CC[NH2+]CC2)O

Isomeric SMILES

C=CCC1=CC=CC=C1OC[C@H](CN2CC[NH2+]CC2)O

InChI

InChI=1S/C16H24N2O2/c1-2-5-14-6-3-4-7-16(14)20-13-15(19)12-18-10-8-17-9-11-18/h2-4,6-7,15,17,19H,1,5,8-13H2/p+1/t15-/m0/s1