ethanoic acid; manganese; N-(1-phenylethyl)-1-pyridin-2-yl-methanimine

Systemtic Name: ethanoic acid; manganese; N-(1-phenylethyl)-1-pyridin-2-yl-methanimine Openeye Name: acetic acid; manganese; N-(1-phenylethyl)-1-(2-pyridyl)methanimine CAS Name: acetic acid; manganese; N-(1-phenylethyl)-1-(2-pyridinyl)methanimine IUPAC Name: acetic acid; manganese; N-(1-phenylethyl)-1-pyridin-2-ylmethanimine Traditional Name: acetic acid; manganese; 1-phenylethyl(2-pyridylmethylene)amine Formula: C40H52Mn3N4O12 MolecularWeight: 945.674627

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N=CC2=CC=CC=N2.CC(C1=CC=CC=C1)N=CC2=CC=CC=N2.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[Mn].[Mn].[Mn]

Isomeric SMILES

CC(C1=CC=CC=C1)N=CC2=CC=CC=N2.CC(C1=CC=CC=C1)N=CC2=CC=CC=N2.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[Mn].[Mn].[Mn]

InChI

InChI=1S/2C14H14N2.6C2H4O2.3Mn/c2*1-12(13-7-3-2-4-8-13)16-11-14-9-5-6-10-15-14;6*1-2(3)4;;;/h2*2-12H,1H3;6*1H3,(H,3,4);;;