carbon monoxide; diphenylphosphane; iron; (E)-3-(propan-2-ylamino)but-2-enal; trimethyl phosphite

Systemtic Name: carbon monoxide; diphenylphosphane; iron; (E)-3-(propan-2-ylamino)but-2-enal; trimethyl phosphite Openeye Name: carbon monoxide; diphenylphosphane; iron; (E)-3-(isopropylamino)but-2-enal; trimethyl phosphite CAS Name: carbon monoxide; diphenylphosphine; iron; phosphorous acid trimethyl ester; (E)-3-(propan-2-ylamino)-2-butenal IUPAC Name: carbon monoxide; diphenylphosphane; iron; (E)-3-(propan-2-ylamino)but-2-enal; trimethyl phosphite Traditional Name: carbon monoxide; diphenylphosphine; iron; (E)-3-(isopropylamino)but-2-enal; phosphorous acid trimethyl ester Formula: C27H33Fe2NO9P2 MolecularWeight: 689.189742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=CC=O)C.COP(OC)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)PC2=CC=CC=C2.[Fe].[Fe]

Isomeric SMILES

CC(C)N/C(=C/C=O)/C.COP(OC)OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)PC2=CC=CC=C2.[Fe].[Fe]

InChI

InChI=1S/C12H11P.C7H13NO.C3H9O3P.5CO.2Fe/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-6(2)8-7(3)4-5-9;1-4-7(5-2)6-3;5*1-2;;/h1-10,13H;4-6,8H,1-3H3;1-3H3;;;;;;;/b;7-4+;;;;;;;;