4-[[bis(pyridin-2-ylmethyl)amino]methyl]benzoic acid; carbon monoxide; molybdenum

Systemtic Name: 4-[[bis(pyridin-2-ylmethyl)amino]methyl]benzoic acid; carbon monoxide; molybdenum Openeye Name: 4-[[bis(2-pyridylmethyl)amino]methyl]benzoic acid; carbon monoxide; molybdenum CAS Name: 4-[[bis(2-pyridinylmethyl)amino]methyl]benzoic acid; carbon monoxide; molybdenum IUPAC Name: 4-[[bis(pyridin-2-ylmethyl)amino]methyl]benzoic acid; carbon monoxide; molybdenum Traditional Name: 4-[[bis(2-pyridylmethyl)amino]methyl]benzoic acid; carbon monoxide; molybdenum Formula: C23H19MoN3O5 MolecularWeight: 513.35406

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=NC(=C1)CN(CC2=CC=C(C=C2)C(=O)O)CC3=CC=CC=N3.[Mo]

Isomeric SMILES

[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=NC(=C1)CN(CC2=CC=C(C=C2)C(=O)O)CC3=CC=CC=N3.[Mo]

InChI

InChI=1S/C20H19N3O2.3CO.Mo/c24-20(25)17-9-7-16(8-10-17)13-23(14-18-5-1-3-11-21-18)15-19-6-2-4-12-22-19;3*1-2;/h1-12H,13-15H2,(H,24,25);;;;