cyclopenta-1,3-diene; 1-cyclopenta-1,3-dien-1-yl-1-phenyl-but-2-yne-1,4-diol; iron(2+)

Systemtic Name: cyclopenta-1,3-diene; 1-cyclopenta-1,3-dien-1-yl-1-phenyl-but-2-yne-1,4-diol; iron(2+) Openeye Name: ferrous; cyclopenta-1,3-diene; 1-cyclopenta-1,3-dien-1-yl-1-phenyl-but-2-yne-1,4-diol CAS Name: cyclopenta-1,3-diene; 1-(1-cyclopenta-1,3-dienyl)-1-phenyl-2-butyne-1,4-diol; iron(2+) IUPAC Name: cyclopenta-1,3-diene; 1-cyclopenta-1,3-dien-1-yl-1-phenylbut-2-yne-1,4-diol; iron(2+) Traditional Name: ferrous; cyclopenta-1,3-diene; 1-cyclopenta-1,3-dien-1-yl-1-phenyl-but-2-yne-1,4-diol Formula: C20H18FeO2 MolecularWeight: 346.20072

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.[CH-]1C=CC=C1C(C#CCO)(C2=CC=CC=C2)O.[Fe+2]

Isomeric SMILES

[CH-]1C=CC=C1.[CH-]1C=CC=C1C(C#CCO)(C2=CC=CC=C2)O.[Fe+2]

InChI

InChI=1S/C15H13O2.C5H5.Fe/c16-12-6-11-15(17,14-9-4-5-10-14)13-7-2-1-3-8-13;1-2-4-5-3-1;/h1-5,7-10,16-17H,12H2;1-5H;/q2*-1;+2