piperidin-1-ium-1-ylmethyl(2-pyridin-4-ylethyl)phosphinate

Systemtic Name: piperidin-1-ium-1-ylmethyl(2-pyridin-4-ylethyl)phosphinate Openeye Name: piperidin-1-ium-1-ylmethyl-[2-(4-pyridyl)ethyl]phosphinate CAS Name: 1-piperidin-1-iumylmethyl(2-pyridin-4-ylethyl)phosphinate IUPAC Name: piperidin-1-ium-1-ylmethyl(2-pyridin-4-ylethyl)phosphinate Traditional Name: piperidin-1-ium-1-ylmethyl-[2-(4-pyridyl)ethyl]phosphinate Formula: C13H21N2O2P MolecularWeight: 268.291801

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CP(=O)(CCC2=CC=NC=C2)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CP(=O)(CCC2=CC=NC=C2)[O-]

InChI

InChI=1S/C13H21N2O2P/c16-18(17,12-15-9-2-1-3-10-15)11-6-13-4-7-14-8-5-13/h4-5,7-8H,1-3,6,9-12H2,(H,16,17)