[4-[4-(4-fluorophenyl)phenyl]-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-[4-(4-fluorophenyl)phenyl]-1-phosphono-butyl]phosphonic acid Openeye Name: [4-[4-(4-fluorophenyl)phenyl]-1-phosphono-butyl]phosphonic acid CAS Name: [4-[4-(4-fluorophenyl)phenyl]-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-[4-(4-fluorophenyl)phenyl]-1-phosphonobutyl]phosphonic acid Traditional Name: [4-[4-(4-fluorophenyl)phenyl]-1-phosphono-butyl]phosphonic acid Formula: C16H19FO6P2 MolecularWeight: 388.264385

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(P(=O)(O)O)P(=O)(O)O)C2=CC=C(C=C2)F

Isomeric SMILES

C1=CC(=CC=C1CCCC(P(=O)(O)O)P(=O)(O)O)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H19FO6P2/c17-15-10-8-14(9-11-15)13-6-4-12(5-7-13)2-1-3-16(24(18,19)20)25(21,22)23/h4-11,16H,1-3H2,(H2,18,19,20)(H2,21,22,23)