bis(chloranyl)iron; N-cyclododecyl-1-[6-(N-cyclododecyl-C-methyl-carbonimidoyl)pyridin-2-yl]ethanimine

Systemtic Name: bis(chloranyl)iron; N-cyclododecyl-1-[6-(N-cyclododecyl-C-methyl-carbonimidoyl)pyridin-2-yl]ethanimine Openeye Name: N-cyclododecyl-1-[6-(N-cyclododecyl-C-methyl-carbonimidoyl)-2-pyridyl]ethanimine; dichloroiron CAS Name: N-cyclododecyl-1-[6-(1-cyclododecyliminoethyl)-2-pyridinyl]ethanimine; dichloroiron IUPAC Name: N-cyclododecyl-1-[6-(N-cyclododecyl-C-methylcarbonimidoyl)pyridin-2-yl]ethanimine; dichloroiron Traditional Name: cyclododecyl-[1-[6-(N-cyclododecyl-C-methyl-carbonimidoyl)-2-pyridyl]ethylidene]amine; dichloroiron Formula: C33H55Cl2FeN3 MolecularWeight: 620.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1CCCCCCCCCCC1)C2=NC(=CC=C2)C(=NC3CCCCCCCCCCC3)C.Cl[Fe]Cl

Isomeric SMILES

CC(=NC1CCCCCCCCCCC1)C2=NC(=CC=C2)C(=NC3CCCCCCCCCCC3)C.Cl[Fe]Cl

InChI

InChI=1S/C33H55N3.2ClH.Fe/c1-28(34-30-22-17-13-9-5-3-6-10-14-18-23-30)32-26-21-27-33(36-32)29(2)35-31-24-19-15-11-7-4-8-12-16-20-25-31;;;/h21,26-27,30-31H,3-20,22-25H2,1-2H3;2*1H;/q;;;+2/p-2