1-[4-(3-cyclohexyloxy-2-oxidanyl-propyl)piperazin-4-ium-1-yl]ethanone; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 1-[4-(3-cyclohexyloxy-2-oxidanyl-propyl)piperazin-4-ium-1-yl]ethanone; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 1-[4-[3-(cyclohexoxy)-2-hydroxy-propyl]piperazin-4-ium-1-yl]ethanone; 2-hydroxy-2-oxo-acetate CAS Name: 1-[4-(3-cyclohexyloxy-2-hydroxypropyl)-1-piperazin-4-iumyl]ethanone; 2-hydroxy-2-oxoacetate IUPAC Name: 1-[4-(3-cyclohexyloxy-2-hydroxypropyl)piperazin-4-ium-1-yl]ethanone; 2-hydroxy-2-oxoacetate Traditional Name: 1-[4-[3-(cyclohexoxy)-2-hydroxy-propyl]piperazin-4-ium-1-yl]ethanone binoxalate Formula: C17H30N2O7 MolecularWeight: 374.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(COC2CCCCC2)O.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(COC2CCCCC2)O.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C15H28N2O3.C2H2O4/c1-13(18)17-9-7-16(8-10-17)11-14(19)12-20-15-5-3-2-4-6-15;3-1(4)2(5)6/h14-15,19H,2-12H2,1H3;(H,3,4)(H,5,6)