cyclopentane; iron; 1-phenoxy-4-(4-prop-2-enylhepta-1,6-dien-4-yl)benzene; hexafluorophosphate

Systemtic Name: cyclopentane; iron; 1-phenoxy-4-(4-prop-2-enylhepta-1,6-dien-4-yl)benzene; hexafluorophosphate Openeye Name: cyclopentane; 1-(1,1-diallylbut-3-enyl)-4-phenoxy-benzene; iron; hexafluorophosphate CAS Name: cyclopentane; iron; 1-phenoxy-4-(4-prop-2-enylhepta-1,6-dien-4-yl)benzene; hexafluorophosphate IUPAC Name: cyclopentane; iron; 1-phenoxy-4-(4-prop-2-enylhepta-1,6-dien-4-yl)benzene; hexafluorophosphate Traditional Name: cyclopentane; 1-(1,1-diallylbut-3-enyl)-4-phenoxy-benzene; iron; hexafluorophosphate Formula: C27H29F6FeOP- MolecularWeight: 570.32774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24O.C5H5.F6P.Fe/c1-4-16-22(17-5-2,18-6-3)19-12-14-21(15-13-19)23-20-10-8-7-9-11-20;1-2-4-5-3-1;1-7(2,3,4,5)6;/h4-15H,1-3,16-18H2;1-5H;;/q;;-1;