carbon monoxide; iron; (2S)-1-(4-methylphenyl)sulfonyl-2-prop-2-enyl-2H-pyrrol-5-one

Systemtic Name: carbon monoxide; iron; (2S)-1-(4-methylphenyl)sulfonyl-2-prop-2-enyl-2H-pyrrol-5-one Openeye Name: (2S)-2-allyl-1-(p-tolylsulfonyl)-2H-pyrrol-5-one; carbon monoxide; iron CAS Name: carbon monoxide; iron; (2S)-1-(4-methylphenyl)sulfonyl-2-prop-2-enyl-2H-pyrrol-5-one IUPAC Name: carbon monoxide; iron; (2S)-1-(4-methylphenyl)sulfonyl-2-prop-2-enyl-2H-pyrrol-5-one Traditional Name: (5S)-5-allyl-1-tosyl-3-pyrrolin-2-one; carbon monoxide; iron Formula: C18H15FeNO7S MolecularWeight: 445.2242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C=CC2=O)CC=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H](C=CC2=O)CC=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C14H15NO3S.4CO.Fe/c1-3-4-12-7-10-14(16)15(12)19(17,18)13-8-5-11(2)6-9-13;4*1-2;/h3,5-10,12H,1,4H2,2H3;;;;;/t12-;;;;;/m0...../s1