[4-bis(4-phosphonophenyl)phosphanylphenyl]phosphonic acid

Systemtic Name: [4-bis(4-phosphonophenyl)phosphanylphenyl]phosphonic acid Openeye Name: [4-bis(4-phosphonophenyl)phosphanylphenyl]phosphonic acid CAS Name: [4-bis(4-phosphonophenyl)phosphinophenyl]phosphonic acid IUPAC Name: [4-bis(4-phosphonophenyl)phosphanylphenyl]phosphonic acid Traditional Name: [4-bis(4-phosphonophenyl)phosphinophenyl]phosphonic acid Formula: C18H18O9P4 MolecularWeight: 502.225164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1P(C2=CC=C(C=C2)P(=O)(O)O)C3=CC=C(C=C3)P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC(=CC=C1P(C2=CC=C(C=C2)P(=O)(O)O)C3=CC=C(C=C3)P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C18H18O9P4/c19-29(20,21)16-7-1-13(2-8-16)28(14-3-9-17(10-4-14)30(22,23)24)15-5-11-18(12-6-15)31(25,26)27/h1-12H,(H2,19,20,21)(H2,22,23,24)(H2,25,26,27)