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

Systemtic Name: (2S)-1-piperidin-1-ium-1-yl-3-(2-prop-2-enylphenoxy)propan-2-ol Openeye Name: (2S)-1-(2-allylphenoxy)-3-piperidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-(1-piperidin-1-iumyl)-3-(2-prop-2-enylphenoxy)-2-propanol IUPAC Name: (2S)-1-piperidin-1-ium-1-yl-3-(2-prop-2-enylphenoxy)propan-2-ol Traditional Name: (2S)-1-(2-allylphenoxy)-3-piperidin-1-ium-1-yl-propan-2-ol Formula: C17H26NO2+ MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC=C1OCC(C[NH+]2CCCCC2)O

Isomeric SMILES

C=CCC1=CC=CC=C1OC[C@H](C[NH+]2CCCCC2)O

InChI

InChI=1S/C17H25NO2/c1-2-8-15-9-4-5-10-17(15)20-14-16(19)13-18-11-6-3-7-12-18/h2,4-5,9-10,16,19H,1,3,6-8,11-14H2/p+1/t16-/m0/s1