[2-(4-chlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(4-chlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(4-chlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(4-chlorophenyl)-1-phenoxy-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(4-chlorophenyl)-1-phenoxy-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(4-chlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid Formula: C14H15ClO7P2 MolecularWeight: 392.665222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CC2=CC=C(C=C2)Cl)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(CC2=CC=C(C=C2)Cl)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H15ClO7P2/c15-12-8-6-11(7-9-12)10-14(23(16,17)18,24(19,20)21)22-13-4-2-1-3-5-13/h1-9H,10H2,(H2,16,17,18)(H2,19,20,21)