[2-(3,4-dichlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(3,4-dichlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(3,4-dichlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(3,4-dichlorophenyl)-1-phenoxy-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(3,4-dichlorophenyl)-1-phenoxy-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(3,4-dichlorophenyl)-1-phenoxy-1-phosphono-ethyl]phosphonic acid Formula: C14H14Cl2O7P2 MolecularWeight: 427.110282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14Cl2O7P2/c15-12-7-6-10(8-13(12)16)9-14(24(17,18)19,25(20,21)22)23-11-4-2-1-3-5-11/h1-8H,9H2,(H2,17,18,19)(H2,20,21,22)