N-(2-tert-butylphenyl)ethanimine; N-(2-tert-butylphenyl)-1-pyridin-3-yl-ethanimine; iron(3+); dichloride

Systemtic Name: N-(2-tert-butylphenyl)ethanimine; N-(2-tert-butylphenyl)-1-pyridin-3-yl-ethanimine; iron(3+); dichloride Openeye Name: ferric; N-(2-tert-butylphenyl)ethanimine; N-(2-tert-butylphenyl)-1-(3-pyridyl)ethanimine; dichloride CAS Name: N-(2-tert-butylphenyl)ethanimine; N-(2-tert-butylphenyl)-1-(3-pyridinyl)ethanimine; iron(3+); dichloride IUPAC Name: N-(2-tert-butylphenyl)ethanimine; N-(2-tert-butylphenyl)-1-pyridin-3-ylethanimine; iron(3+); dichloride Traditional Name: ferric; (2-tert-butylphenyl)-ethylidene-amine; (2-tert-butylphenyl)-[1-(3-pyridyl)ethylidene]amine; dichloride Formula: C29H36Cl2FeN3 MolecularWeight: 553.36724

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]=NC1=CC=CC=C1C(C)(C)C.CC(=NC1=CC=CC=C1C(C)(C)C)C2=CN=CC=C2.[Cl-].[Cl-].[Fe+3]

Isomeric SMILES

C[C-]=NC1=CC=CC=C1C(C)(C)C.CC(=NC1=CC=CC=C1C(C)(C)C)C2=CN=CC=C2.[Cl-].[Cl-].[Fe+3]

InChI

InChI=1S/C17H20N2.C12H16N.2ClH.Fe/c1-13(14-8-7-11-18-12-14)19-16-10-6-5-9-15(16)17(2,3)4;1-5-13-11-9-7-6-8-10(11)12(2,3)4;;;/h5-12H,1-4H3;6-9H,1-4H3;2*1H;/q;-1;;;+3/p-2