(2S)-1-(4-ethylphenoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2S)-1-(4-ethylphenoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2S)-1-(4-ethylphenoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(4-ethylphenoxy)-3-(4-ethyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-(4-ethylphenoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(4-ethylphenoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C17H29N2O2+ MolecularWeight: 293.42436

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(CN2CC[NH+](CC2)CC)O

Isomeric SMILES

CCC1=CC=C(C=C1)OC[C@H](CN2CC[NH+](CC2)CC)O

InChI

InChI=1S/C17H28N2O2/c1-3-15-5-7-17(8-6-15)21-14-16(20)13-19-11-9-18(4-2)10-12-19/h5-8,16,20H,3-4,9-14H2,1-2H3/p+1/t16-/m0/s1