(2S)-1-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]-2-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: (2S)-1-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]-2-piperazin-4-ium-1-yl-propan-1-one Openeye Name: (2S)-1-[(2S)-2-(2-hydroxyethyl)-1-piperidyl]-2-piperazin-4-ium-1-yl-propan-1-one CAS Name: (2S)-1-[(2S)-2-(2-hydroxyethyl)-1-piperidinyl]-2-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: (2S)-1-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]-2-piperazin-4-ium-1-ylpropan-1-one Traditional Name: (2S)-1-[(2S)-2-(2-hydroxyethyl)piperidino]-2-piperazin-4-ium-1-yl-propan-1-one Formula: C14H28N3O2+ MolecularWeight: 270.39102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCC1CCO)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](C(=O)N1CCCC[C@H]1CCO)N2CC[NH2+]CC2

InChI

InChI=1S/C14H27N3O2/c1-12(16-9-6-15-7-10-16)14(19)17-8-3-2-4-13(17)5-11-18/h12-13,15,18H,2-11H2,1H3/p+1/t12-,13-/m0/s1