(2-azanyl-1-oxidanyl-1-phosphonato-ethyl)-(3-hexadecoxypropoxy)phosphinate

Systemtic Name: (2-azanyl-1-oxidanyl-1-phosphonato-ethyl)-(3-hexadecoxypropoxy)phosphinate Openeye Name: (2-amino-1-hydroxy-1-phosphonato-ethyl)-(3-hexadecoxypropoxy)phosphinate CAS Name: (2-amino-1-hydroxy-1-phosphonatoethyl)-(3-hexadecoxypropoxy)phosphinate IUPAC Name: (2-amino-1-hydroxy-1-phosphonatoethyl)-(3-hexadecoxypropoxy)phosphinate Traditional Name: (2-amino-1-hydroxy-1-phosphonato-ethyl)-(3-cetyloxypropoxy)phosphinate Formula: C21H44NO8P2-3 MolecularWeight: 500.523482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCCOP(=O)(C(CN)(O)P(=O)([O-])[O-])[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCCOP(=O)(C(CN)(O)P(=O)([O-])[O-])[O-]

InChI

InChI=1S/C21H47NO8P2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-29-18-16-19-30-32(27,28)21(23,20-22)31(24,25)26/h23H,2-20,22H2,1H3,(H,27,28)(H2,24,25,26)/p-3