cyclopenta-1,3-diene; iron; 15-sulfanylpentadecyl cyclopenta-2,4-diene-1-carboxylate

Systemtic Name: cyclopenta-1,3-diene; iron; 15-sulfanylpentadecyl cyclopenta-2,4-diene-1-carboxylate Openeye Name: cyclopenta-1,3-diene; iron; 15-sulfanylpentadecyl cyclopenta-2,4-diene-1-carboxylate CAS Name: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dienecarboxylic acid 15-mercaptopentadecyl ester; iron IUPAC Name: cyclopenta-1,3-diene; iron; 15-sulfanylpentadecyl cyclopenta-2,4-diene-1-carboxylate Traditional Name: cyclopenta-1,3-diene; cyclopenta-2,4-diene-1-carboxylic acid 15-mercaptopentadecyl ester; iron Formula: C26H40FeO2S-2 MolecularWeight: 472.5046

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.C1=C[C-](C=C1)C(=O)OCCCCCCCCCCCCCCCS.[Fe]

Isomeric SMILES

[CH-]1C=CC=C1.C1=C[C-](C=C1)C(=O)OCCCCCCCCCCCCCCCS.[Fe]

InChI

InChI=1S/C21H35O2S.C5H5.Fe/c22-21(20-16-12-13-17-20)23-18-14-10-8-6-4-2-1-3-5-7-9-11-15-19-24;1-2-4-5-3-1;/h12-13,16-17,24H,1-11,14-15,18-19H2;1-5H;/q2*-1;