cyclopenta-1,3-diene; (2-ethyl-5-propyl-phenyl)methanone; iron(2+); methanal

Systemtic Name: cyclopenta-1,3-diene; (2-ethyl-5-propyl-phenyl)methanone; iron(2+); methanal Openeye Name: ferrous; cyclopenta-1,3-diene; (2-ethyl-5-propyl-phenyl)methanone; formaldehyde CAS Name: cyclopenta-1,3-diene; (2-ethyl-5-propylphenyl)methanone; formaldehyde; iron(2+) IUPAC Name: cyclopenta-1,3-diene; (2-ethyl-5-propylphenyl)methanone; formaldehyde; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; (2-ethyl-5-propyl-phenyl)methanone; formaldehyde Formula: C20H26FeO4 MolecularWeight: 386.26304

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)CC)[C-]=O.C=O.C=O.C=O.C1C=CC=[C-]1.[Fe+2]

Isomeric SMILES

CCCC1=CC(=C(C=C1)CC)[C-]=O.C=O.C=O.C=O.C1C=CC=[C-]1.[Fe+2]

InChI

InChI=1S/C12H15O.C5H5.3CH2O.Fe/c1-3-5-10-6-7-11(4-2)12(8-10)9-13;1-2-4-5-3-1;3*1-2;/h6-8H,3-5H2,1-2H3;1-3H,4H2;3*1H2;/q2*-1;;;;+2