bis(chloranyl)iron; N-[(6-bromanyl-2H-pyridin-1-id-2-yl)methyl]-1-piperidin-1-id-2-yl-N-(piperidin-1-id-2-ylmethyl)methanamine

Systemtic Name: bis(chloranyl)iron; N-[(6-bromanyl-2H-pyridin-1-id-2-yl)methyl]-1-piperidin-1-id-2-yl-N-(piperidin-1-id-2-ylmethyl)methanamine Openeye Name: N-[(6-bromo-2H-pyridin-1-id-2-yl)methyl]-1-piperidin-1-id-2-yl-N-(piperidin-1-id-2-ylmethyl)methanamine; dichloroiron CAS Name: N-[(6-bromo-2H-pyridin-1-id-2-yl)methyl]-1-(2-piperidin-1-idyl)-N-(2-piperidin-1-idylmethyl)methanamine; dichloroiron IUPAC Name: N-[(6-bromo-2H-pyridin-1-id-2-yl)methyl]-1-piperidin-1-id-2-yl-N-(piperidin-1-id-2-ylmethyl)methanamine; dichloroiron Traditional Name: (6-bromo-2H-pyridin-1-id-2-yl)methyl-bis(piperidin-1-id-2-ylmethyl)amine; dichloroiron Formula: C18H28BrCl2FeN4-3 MolecularWeight: 507.09672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N-]C(C1)CN(CC2CCCC[N-]2)CC3C=CC=C([N-]3)Br.Cl[Fe]Cl

Isomeric SMILES

C1CC[N-]C(C1)CN(CC2CCCC[N-]2)CC3C=CC=C([N-]3)Br.Cl[Fe]Cl

InChI

InChI=1S/C18H28BrN4.2ClH.Fe/c19-18-9-5-8-17(22-18)14-23(12-15-6-1-3-10-20-15)13-16-7-2-4-11-21-16;;;/h5,8-9,15-17H,1-4,6-7,10-14H2;2*1H;/q-3;;;+2/p-2