disodium N,N-bis(diphenylphosphanylmethyl)-2-phosphonato-ethanamine

Systemtic Name: disodium N,N-bis(diphenylphosphanylmethyl)-2-phosphonato-ethanamine Openeye Name: disodium N,N-bis(diphenylphosphanylmethyl)-2-phosphonato-ethanamine CAS Name: disodium N,N-bis(diphenylphosphinomethyl)-2-phosphonatoethanamine IUPAC Name: disodium N,N-bis(diphenylphosphanylmethyl)-2-phosphonatoethanamine Traditional Name: disodium bis(diphenylphosphinomethyl)-(2-phosphonatoethyl)amine Formula: C28H28NNa2O3P3 MolecularWeight: 565.427643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(CN(CCP(=O)([O-])[O-])CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)P(CN(CCP(=O)([O-])[O-])CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Na+].[Na+]

InChI

InChI=1S/C28H30NO3P3.2Na/c30-35(31,32)22-21-29(23-33(25-13-5-1-6-14-25)26-15-7-2-8-16-26)24-34(27-17-9-3-10-18-27)28-19-11-4-12-20-28;;/h1-20H,21-24H2,(H2,30,31,32);;/q;2*+1/p-2