cyclopenta-1,3-diene; iron(2+); [4-(7-prop-2-enoyloxyheptyl)phenyl] cyclopenta-1,3-diene-1-carboxylate

Systemtic Name: cyclopenta-1,3-diene; iron(2+); [4-(7-prop-2-enoyloxyheptyl)phenyl] cyclopenta-1,3-diene-1-carboxylate Openeye Name: ferrous; cyclopenta-1,3-diene; [4-(7-prop-2-enoyloxyheptyl)phenyl] cyclopenta-1,3-diene-1-carboxylate CAS Name: cyclopenta-1,3-diene; 1-cyclopenta-1,3-dienecarboxylic acid [4-[7-(1-oxoprop-2-enoxy)heptyl]phenyl] ester; iron(2+) IUPAC Name: cyclopenta-1,3-diene; iron(2+); [4-(7-prop-2-enoyloxyheptyl)phenyl] cyclopenta-1,3-diene-1-carboxylate Traditional Name: ferrous; cyclopenta-1,3-diene; cyclopenta-1,3-diene-1-carboxylic acid [4-(7-acryloyloxyheptyl)phenyl] ester Formula: C27H30FeO4 MolecularWeight: 474.3697

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C[CH-]2.C1C=C[C-]=C1.[Fe+2]

Isomeric SMILES

C=CC(=O)OCCCCCCCC1=CC=C(C=C1)OC(=O)C2=CC=C[CH-]2.C1C=C[C-]=C1.[Fe+2]

InChI

InChI=1S/C22H25O4.C5H5.Fe/c1-2-21(23)25-17-9-5-3-4-6-10-18-13-15-20(16-14-18)26-22(24)19-11-7-8-12-19;1-2-4-5-3-1;/h2,7-8,11-16H,1,3-6,9-10,17H2;1-2,5H,3H2;/q2*-1;+2