5-(chloromethyl)-2,3-dimethyl-cyclohexa-2,5-diene-1,4-dione; cobalt; cyclopenta-1,3-diene

Systemtic Name: 5-(chloromethyl)-2,3-dimethyl-cyclohexa-2,5-diene-1,4-dione; cobalt; cyclopenta-1,3-diene Openeye Name: 5-(chloromethyl)-2,3-dimethyl-1,4-benzoquinone; cobalt; cyclopenta-1,3-diene CAS Name: 5-(chloromethyl)-2,3-dimethylcyclohexa-2,5-diene-1,4-dione; cobalt; cyclopenta-1,3-diene IUPAC Name: 5-(chloromethyl)-2,3-dimethylcyclohexa-2,5-diene-1,4-dione; cobalt; cyclopenta-1,3-diene Traditional Name: 5-(chloromethyl)-2,3-dimethyl-p-benzoquinone; cobalt; cyclopenta-1,3-diene Formula: C14H13ClCoO2-2 MolecularWeight: 307.63802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=[C-]C1=O)CCl)C.[CH-]1C=CC=C1.[Co]

Isomeric SMILES

CC1=C(C(=O)C(=[C-]C1=O)CCl)C.[CH-]1C=CC=C1.[Co]

InChI

InChI=1S/C9H8ClO2.C5H5.Co/c1-5-6(2)9(12)7(4-10)3-8(5)11;1-2-4-5-3-1;/h4H2,1-2H3;1-5H;/q2*-1;