cyclopenta-1,3-diene; N-(3,5-dipyridin-2-yl-1,2,4-triazol-4-yl)cyclopenta-2,4-diene-1-carboxamide; iron

Systemtic Name: cyclopenta-1,3-diene; N-(3,5-dipyridin-2-yl-1,2,4-triazol-4-yl)cyclopenta-2,4-diene-1-carboxamide; iron Openeye Name: N-[3,5-bis(2-pyridyl)-1,2,4-triazol-4-yl]cyclopenta-2,4-diene-1-carboxamide; cyclopenta-1,3-diene; iron CAS Name: N-[3,5-bis(2-pyridinyl)-1,2,4-triazol-4-yl]-1-cyclopenta-2,4-dienecarboxamide; cyclopenta-1,3-diene; iron IUPAC Name: cyclopenta-1,3-diene; N-(3,5-dipyridin-2-yl-1,2,4-triazol-4-yl)cyclopenta-2,4-diene-1-carboxamide; iron Traditional Name: N-[3,5-bis(2-pyridyl)-1,2,4-triazol-4-yl]cyclopenta-2,4-diene-1-carboxamide; cyclopenta-1,3-diene; iron Formula: C23H18FeN6O-2 MolecularWeight: 450.27362

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.C1=CC=NC(=C1)C2=NN=C(N2NC(=O)[C-]3C=CC=C3)C4=CC=CC=N4.[Fe]

Isomeric SMILES

[CH-]1C=CC=C1.C1=CC=NC(=C1)C2=NN=C(N2NC(=O)[C-]3C=CC=C3)C4=CC=CC=N4.[Fe]

InChI

InChI=1S/C18H13N6O.C5H5.Fe/c25-18(13-7-1-2-8-13)23-24-16(14-9-3-5-11-19-14)21-22-17(24)15-10-4-6-12-20-15;1-2-4-5-3-1;/h1-12H,(H,23,25);1-5H;/q2*-1;