cyclopentane; (2E)-2-(cyclopentylmethylidene)-5-methoxy-3,4-dihydronaphthalen-1-one; iron(2+)

Systemtic Name: cyclopentane; (2E)-2-(cyclopentylmethylidene)-5-methoxy-3,4-dihydronaphthalen-1-one; iron(2+) Openeye Name: ferrous; cyclopentane; (2E)-2-(cyclopentylmethylene)-5-methoxy-tetralin-1-one CAS Name: cyclopentane; (2E)-2-(cyclopentylmethylidene)-5-methoxy-3,4-dihydronaphthalen-1-one; iron(2+) IUPAC Name: cyclopentane; (2E)-2-(cyclopentylmethylidene)-5-methoxy-3,4-dihydronaphthalen-1-one; iron(2+) Traditional Name: ferrous; cyclopentane; (2E)-2-(cyclopentylmethylene)-5-methoxy-tetralin-1-one Formula: C22H20FeO2+2 MolecularWeight: 372.238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CCC(=C[C]3[CH][CH][CH][CH]3)C2=O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

COC1=CC=CC2=C1CC/C(=C\[C]3[CH][CH][CH][CH]3)/C2=O.[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C17H15O2.C5H5.Fe/c1-19-16-8-4-7-15-14(16)10-9-13(17(15)18)11-12-5-2-3-6-12;1-2-4-5-3-1;/h2-8,11H,9-10H2,1H3;1-5H;/q;;+2