carbon monoxide; manganese; methylcyclopentane; (4S,5R)-4-methyl-5-phenyl-cyclohex-2-en-1-one

Systemtic Name: carbon monoxide; manganese; methylcyclopentane; (4S,5R)-4-methyl-5-phenyl-cyclohex-2-en-1-one Openeye Name: carbon monoxide; manganese; methylcyclopentane; (4S,5R)-4-methyl-5-phenyl-cyclohex-2-en-1-one CAS Name: carbon monoxide; manganese; methylcyclopentane; (4S,5R)-4-methyl-5-phenyl-1-cyclohex-2-enone IUPAC Name: carbon monoxide; manganese; methylcyclopentane; (4S,5R)-4-methyl-5-phenylcyclohex-2-en-1-one Traditional Name: carbon monoxide; manganese; methylcyclopentane; (4S,5R)-4-methyl-5-phenyl-cyclohex-2-en-1-one Formula: C21H21MnO3 MolecularWeight: 376.327689

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(=O)CC1C2=CC=CC=C2.C[C]1[CH][CH][CH][CH]1.[C-]#[O+].[C-]#[O+].[Mn]

Isomeric SMILES

C[C@H]1C=CC(=O)C[C@H]1C2=CC=CC=C2.C[C]1[CH][CH][CH][CH]1.[C-]#[O+].[C-]#[O+].[Mn]

InChI

InChI=1S/C13H14O.C6H7.2CO.Mn/c1-10-7-8-12(14)9-13(10)11-5-3-2-4-6-11;1-6-4-2-3-5-6;2*1-2;/h2-8,10,13H,9H2,1H3;2-5H,1H3;;;/t10-,13+;;;;/m0..../s1