1-di(piperidin-1-yl)phosphoryl-1-phosphonato-ethanol; piperidin-1-ium

Systemtic Name: 1-di(piperidin-1-yl)phosphoryl-1-phosphonato-ethanol; piperidin-1-ium Openeye Name: 1-[bis(1-piperidyl)phosphoryl]-1-phosphonato-ethanol; piperidin-1-ium CAS Name: 1-[bis(1-piperidinyl)phosphoryl]-1-phosphonatoethanol; piperidin-1-ium IUPAC Name: 1-di(piperidin-1-yl)phosphoryl-1-phosphonatoethanol; piperidin-1-ium Traditional Name: 1-dipiperidinophosphoryl-1-phosphonato-ethanol; piperidin-1-ium Formula: C22H48N4O5P2 MolecularWeight: 510.587842

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Descriptors Computed from Structure

Canonical SMILES:

CC(O)(P(=O)(N1CCCCC1)N2CCCCC2)P(=O)([O-])[O-].C1CC[NH2+]CC1.C1CC[NH2+]CC1

Isomeric SMILES

CC(O)(P(=O)(N1CCCCC1)N2CCCCC2)P(=O)([O-])[O-].C1CC[NH2+]CC1.C1CC[NH2+]CC1

InChI

InChI=1S/C12H26N2O5P2.2C5H11N/c1-12(15,21(17,18)19)20(16,13-8-4-2-5-9-13)14-10-6-3-7-11-14;2*1-2-4-6-5-3-1/h15H,2-11H2,1H3,(H2,17,18,19);2*6H,1-5H2