cyclopenta-1,3-diene; iron; 2,3,4,7-tetrahydro-1H-inden-2-yl cyclopenta-2,4-diene-1-carboxylate

Systemtic Name: cyclopenta-1,3-diene; iron; 2,3,4,7-tetrahydro-1H-inden-2-yl cyclopenta-2,4-diene-1-carboxylate Openeye Name: cyclopenta-1,3-diene; iron; 2,3,4,7-tetrahydro-1H-inden-2-yl cyclopenta-2,4-diene-1-carboxylate CAS Name: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dienecarboxylic acid 2,3,4,7-tetrahydro-1H-inden-2-yl ester; iron IUPAC Name: cyclopenta-1,3-diene; iron; 2,3,4,7-tetrahydro-1H-inden-2-yl cyclopenta-2,4-diene-1-carboxylate Traditional Name: cyclopenta-1,3-diene; cyclopenta-2,4-diene-1-carboxylic acid 2,3,4,7-tetrahydro-1H-inden-2-yl ester; iron Formula: C20H20FeO2-2 MolecularWeight: 348.2166

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2=C1CC(C2)OC(=O)[C-]3C=CC=C3.[CH-]1C=CC=C1.[Fe]

Isomeric SMILES

C1C=CCC2=C1CC(C2)OC(=O)[C-]3C=CC=C3.[CH-]1C=CC=C1.[Fe]

InChI

InChI=1S/C15H15O2.C5H5.Fe/c16-15(11-5-1-2-6-11)17-14-9-12-7-3-4-8-13(12)10-14;1-2-4-5-3-1;/h1-6,14H,7-10H2;1-5H;/q2*-1;