1-[2-butyl-1-(1-hydroxyethyl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 1-[2-butyl-1-(1-hydroxyethyl)piperazin-1-ium-1-yl]ethanol Openeye Name: 1-[2-butyl-1-(1-hydroxyethyl)piperazin-1-ium-1-yl]ethanol CAS Name: 1-[2-butyl-1-(1-hydroxyethyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 1-[2-butyl-1-(1-hydroxyethyl)piperazin-1-ium-1-yl]ethanol Traditional Name: 1-[2-butyl-1-(1-hydroxyethyl)piperazin-1-ium-1-yl]ethanol Formula: C12H27N2O2+ MolecularWeight: 231.35498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CNCC[N+]1(C(C)O)C(C)O

Isomeric SMILES

CCCCC1CNCC[N+]1(C(C)O)C(C)O

InChI

InChI=1S/C12H27N2O2/c1-4-5-6-12-9-13-7-8-14(12,10(2)15)11(3)16/h10-13,15-16H,4-9H2,1-3H3/q+1