2-diphenylphosphanyl-N-(3-oxidanylpropyl)cyclopentane-1-carboxamide; iron(2+)

Systemtic Name: 2-diphenylphosphanyl-N-(3-oxidanylpropyl)cyclopentane-1-carboxamide; iron(2+) Openeye Name: ferrous 2-diphenylphosphanyl-N-(3-hydroxypropyl)cyclopentanecarboxamide CAS Name: 2-diphenylphosphino-N-(3-hydroxypropyl)-1-cyclopentanecarboxamide; iron(2+) IUPAC Name: 2-diphenylphosphanyl-N-(3-hydroxypropyl)cyclopentane-1-carboxamide; iron(2+) Traditional Name: ferrous 2-diphenylphosphino-N-(3-hydroxypropyl)cyclopentanecarboxamide Formula: C42H42FeN2O4P2+2 MolecularWeight: 756.586402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][C]3C(=O)NCCCO.C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][C]3C(=O)NCCCO.[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][C]3C(=O)NCCCO.C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][C]3C(=O)NCCCO.[Fe+2]

InChI

InChI=1S/2C21H21NO2P.Fe/c2*23-16-8-15-22-21(24)19-13-7-14-20(19)25(17-9-3-1-4-10-17)18-11-5-2-6-12-18;/h2*1-7,9-14,23H,8,15-16H2,(H,22,24);/q;;+2