sodium 1,2-bis(diphenylphosphoryl)benzene phenoxide

Systemtic Name: sodium 1,2-bis(diphenylphosphoryl)benzene phenoxide Openeye Name: sodium 1,2-bis(diphenylphosphoryl)benzene phenoxide CAS Name: sodium 1,2-bis(diphenylphosphoryl)benzene phenoxide IUPAC Name: sodium 1,2-bis(diphenylphosphoryl)benzene phenoxide Traditional Name: sodium 1,2-bis(diphenylphosphoryl)benzene phenoxide Formula: C66H53NaO5P4 MolecularWeight: 1073.008834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3P(=O)(C4=CC=CC=C4)C5=CC=CC=C5.C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3P(=O)(C4=CC=CC=C4)C5=CC=CC=C5.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3P(=O)(C4=CC=CC=C4)C5=CC=CC=C5.C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3P(=O)(C4=CC=CC=C4)C5=CC=CC=C5.[Na+]

InChI

InChI=1S/2C30H24O2P2.C6H6O.Na/c2*31-33(25-15-5-1-6-16-25,26-17-7-2-8-18-26)29-23-13-14-24-30(29)34(32,27-19-9-3-10-20-27)28-21-11-4-12-22-28;7-6-4-2-1-3-5-6;/h2*1-24H;1-5,7H;/q;;;+1/p-1