iron(3+); [oxidanyl(phosphonato)methyl]-phenoxy-phosphinate; phenylmethanol

Systemtic Name: iron(3+); [oxidanyl(phosphonato)methyl]-phenoxy-phosphinate; phenylmethanol Openeye Name: ferric; [hydroxy(phosphonato)methyl]-phenoxy-phosphinate; phenylmethanol CAS Name: [hydroxy(phosphonato)methyl]-phenoxyphosphinate; iron(3+); phenylmethanol IUPAC Name: [hydroxy(phosphonato)methyl]-phenoxyphosphinate; iron(3+); phenylmethanol Traditional Name: ferric; [hydroxy(phosphonato)methyl]-phenoxy-phosphinate; phenylmethanol Formula: C14H15FeO8P2 MolecularWeight: 429.056622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CO.C1=CC=C(C=C1)OP(=O)(C(O)P(=O)([O-])[O-])[O-].[Fe+3]

Isomeric SMILES

C1=CC=C(C=C1)CO.C1=CC=C(C=C1)OP(=O)(C(O)P(=O)([O-])[O-])[O-].[Fe+3]

InChI

InChI=1S/C7H10O7P2.C7H8O.Fe/c8-7(15(9,10)11)16(12,13)14-6-4-2-1-3-5-6;8-6-7-4-2-1-3-5-7;/h1-5,7-8H,(H,12,13)(H2,9,10,11);1-5,8H,6H2;/q;;+3/p-3