1-[4-(3-butoxy-2-oxidanyl-propyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-(3-butoxy-2-oxidanyl-propyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-(3-butoxy-2-hydroxy-propyl)piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-(3-butoxy-2-hydroxypropyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-(3-butoxy-2-hydroxypropyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-(3-butoxy-2-hydroxy-propyl)piperazin-4-ium-1-yl]ethanone Formula: C13H27N2O3+ MolecularWeight: 259.36508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(C[NH+]1CCN(CC1)C(=O)C)O

Isomeric SMILES

CCCCOCC(C[NH+]1CCN(CC1)C(=O)C)O

InChI

InChI=1S/C13H26N2O3/c1-3-4-9-18-11-13(17)10-14-5-7-15(8-6-14)12(2)16/h13,17H,3-11H2,1-2H3/p+1