cyclopentane; [(4S,6S)-2,6-dimethyl-8-oxidanylidene-oct-1-en-4-yl] 2-diphenylphosphanylcyclopentane-1-carboxylate; iron(2+)

Systemtic Name: cyclopentane; [(4S,6S)-2,6-dimethyl-8-oxidanylidene-oct-1-en-4-yl] 2-diphenylphosphanylcyclopentane-1-carboxylate; iron(2+) Openeye Name: ferrous; cyclopentane; [(1S,3S)-3-methyl-1-(2-methylallyl)-5-oxo-pentyl] 2-diphenylphosphanylcyclopentanecarboxylate CAS Name: cyclopentane; 2-diphenylphosphino-1-cyclopentanecarboxylic acid [(4S,6S)-2,6-dimethyl-8-oxooct-1-en-4-yl] ester; iron(2+) IUPAC Name: cyclopentane; [(4S,6S)-2,6-dimethyl-8-oxooct-1-en-4-yl] 2-diphenylphosphanylcyclopentane-1-carboxylate; iron(2+) Traditional Name: ferrous; cyclopentane; 2-diphenylphosphinocyclopentanecarboxylic acid [(1S)-1-[(2S)-4-keto-2-methyl-butyl]-3-methyl-but-3-enyl] ester Formula: C33H35FeO3P+2 MolecularWeight: 566.447961

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)CC(CC(=C)C)OC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

C[C@H](CC=O)C[C@@H](CC(=C)C)OC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C28H30O3P.C5H5.Fe/c1-21(2)19-23(20-22(3)17-18-29)31-28(30)26-15-10-16-27(26)32(24-11-6-4-7-12-24)25-13-8-5-9-14-25;1-2-4-5-3-1;/h4-16,18,22-23H,1,17,19-20H2,2-3H3;1-5H;/q;;+2/t22-,23-;;/m1../s1