cyclopentane; iron; methyl 4-(4-chloranylphenoxy)benzoate; hexafluorophosphate

Systemtic Name: cyclopentane; iron; methyl 4-(4-chloranylphenoxy)benzoate; hexafluorophosphate Openeye Name: cyclopentane; iron; methyl 4-(4-chlorophenoxy)benzoate; hexafluorophosphate CAS Name: 4-(4-chlorophenoxy)benzoic acid methyl ester; cyclopentane; iron; hexafluorophosphate IUPAC Name: cyclopentane; iron; methyl 4-(4-chlorophenoxy)benzoate; hexafluorophosphate Traditional Name: 4-(4-chlorophenoxy)benzoic acid methyl ester; cyclopentane; iron; hexafluorophosphate Formula: C19H16ClF6FeO3P- MolecularWeight: 528.59072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Cl.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe]

InChI

InChI=1S/C14H11ClO3.C5H5.F6P.Fe/c1-17-14(16)10-2-6-12(7-3-10)18-13-8-4-11(15)5-9-13;1-2-4-5-3-1;1-7(2,3,4,5)6;/h2-9H,1H3;1-5H;;/q;;-1;