[6-(4-chloranylphenoxy)-1-phosphono-hexyl]phosphonic acid

Systemtic Name: [6-(4-chloranylphenoxy)-1-phosphono-hexyl]phosphonic acid Openeye Name: [6-(4-chlorophenoxy)-1-phosphono-hexyl]phosphonic acid CAS Name: [6-(4-chlorophenoxy)-1-phosphonohexyl]phosphonic acid IUPAC Name: [6-(4-chlorophenoxy)-1-phosphonohexyl]phosphonic acid Traditional Name: [6-(4-chlorophenoxy)-1-phosphono-hexyl]phosphonic acid Formula: C12H19ClO7P2 MolecularWeight: 372.675582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCCCC(P(=O)(O)O)P(=O)(O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1OCCCCCC(P(=O)(O)O)P(=O)(O)O)Cl

InChI

InChI=1S/C12H19ClO7P2/c13-10-5-7-11(8-6-10)20-9-3-1-2-4-12(21(14,15)16)22(17,18)19/h5-8,12H,1-4,9H2,(H2,14,15,16)(H2,17,18,19)