(E)-3-chloranylprop-2-enoate; iron(3+)

Systemtic Name: (E)-3-chloranylprop-2-enoate; iron(3+) Openeye Name: ferric (E)-3-chloroprop-2-enoate CAS Name: (E)-3-chloro-2-propenoate; iron(3+) IUPAC Name: (E)-3-chloroprop-2-enoate; iron(3+) Traditional Name: ferric (E)-3-chloroacrylate Formula: C9H6Cl3FeO6 MolecularWeight: 372.34434

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Descriptors Computed from Structure

Canonical SMILES:

C(=CCl)C(=O)[O-].C(=CCl)C(=O)[O-].C(=CCl)C(=O)[O-].[Fe+3]

Isomeric SMILES

C(=C/Cl)\C(=O)[O-].C(=C/Cl)\C(=O)[O-].C(=C/Cl)\C(=O)[O-].[Fe+3]

InChI

InChI=1S/3C3H3ClO2.Fe/c3*4-2-1-3(5)6;/h3*1-2H,(H,5,6);/q;;;+3/p-3/b3*2-1+;