N-[(E)-1-cyclopenta-1,3-dien-1-ylethylideneamino]benzamide; iron(2+)

Systemtic Name: N-[(E)-1-cyclopenta-1,3-dien-1-ylethylideneamino]benzamide; iron(2+) Openeye Name: ferrous N-[(E)-1-cyclopenta-1,3-dien-1-ylethylideneamino]benzamide CAS Name: N-[(E)-1-(1-cyclopenta-1,3-dienyl)ethylideneamino]benzamide; iron(2+) IUPAC Name: N-[(E)-1-cyclopenta-1,3-dien-1-ylethylideneamino]benzamide; iron(2+) Traditional Name: ferrous N-[(E)-1-cyclopenta-1,3-dien-1-ylethylideneamino]benzamide Formula: C28H26FeN4O2 MolecularWeight: 506.37664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=C1)C2=CC=C[CH-]2.CC(=NNC(=O)C1=CC=CC=C1)C2=CC=C[CH-]2.[Fe+2]

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=CC=C1)/C2=CC=C[CH-]2.C/C(=N\NC(=O)C1=CC=CC=C1)/C2=CC=C[CH-]2.[Fe+2]

InChI

InChI=1S/2C14H13N2O.Fe/c2*1-11(12-7-5-6-8-12)15-16-14(17)13-9-3-2-4-10-13;/h2*2-10H,1H3,(H,16,17);/q2*-1;+2/b2*15-11+;