(1S)-1-(3-ethoxyphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethanol

Systemtic Name: (1S)-1-(3-ethoxyphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethanol Openeye Name: (1S)-1-(3-ethoxyphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethanol CAS Name: (1S)-1-(3-ethoxyphenyl)-2-(4-ethyl-1-piperazin-4-iumyl)ethanol IUPAC Name: (1S)-1-(3-ethoxyphenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethanol Traditional Name: (1S)-2-(4-ethylpiperazin-4-ium-1-yl)-1-m-phenetyl-ethanol Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2/c1-3-17-8-10-18(11-9-17)13-16(19)14-6-5-7-15(12-14)20-4-2/h5-7,12,16,19H,3-4,8-11,13H2,1-2H3/p+1/t16-/m1/s1