cyclopenta-1,3-diene; iron; N-(phenylmethyl)cyclopenta-2,4-diene-1-carboxamide

Systemtic Name: cyclopenta-1,3-diene; iron; N-(phenylmethyl)cyclopenta-2,4-diene-1-carboxamide Openeye Name: N-benzylcyclopenta-2,4-diene-1-carboxamide; cyclopenta-1,3-diene; iron CAS Name: cyclopenta-1,3-diene; iron; N-(phenylmethyl)-1-cyclopenta-2,4-dienecarboxamide IUPAC Name: N-benzylcyclopenta-2,4-diene-1-carboxamide; cyclopenta-1,3-diene; iron Traditional Name: N-benzylcyclopenta-2,4-diene-1-carboxamide; cyclopenta-1,3-diene; iron Formula: C18H17FeNO-2 MolecularWeight: 319.17868

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.C1=CC=C(C=C1)CNC(=O)[C-]2C=CC=C2.[Fe]

Isomeric SMILES

[CH-]1C=CC=C1.C1=CC=C(C=C1)CNC(=O)[C-]2C=CC=C2.[Fe]

InChI

InChI=1S/C13H12NO.C5H5.Fe/c15-13(12-8-4-5-9-12)14-10-11-6-2-1-3-7-11;1-2-4-5-3-1;/h1-9H,10H2,(H,14,15);1-5H;/q2*-1;