cyclopenta-2,4-diene-1-carbaldehyde; 1-(2-cyclopenta-2,4-dien-1-ylethenyl)-4-nitro-benzene; iron

Systemtic Name: cyclopenta-2,4-diene-1-carbaldehyde; 1-(2-cyclopenta-2,4-dien-1-ylethenyl)-4-nitro-benzene; iron Openeye Name: cyclopenta-2,4-diene-1-carbaldehyde; 1-(2-cyclopenta-2,4-dien-1-ylvinyl)-4-nitro-benzene; iron CAS Name: 1-cyclopenta-2,4-dienecarboxaldehyde; 1-[2-(1-cyclopenta-2,4-dienyl)ethenyl]-4-nitrobenzene; iron IUPAC Name: cyclopenta-2,4-diene-1-carbaldehyde; 1-(2-cyclopenta-2,4-dien-1-ylethenyl)-4-nitrobenzene; iron Traditional Name: cyclopenta-2,4-diene-1-carbaldehyde; 1-(2-cyclopenta-2,4-dien-1-ylvinyl)-4-nitro-benzene; iron Formula: C19H15FeNO3-2 MolecularWeight: 361.1723

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[C-](C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-].C1=C[C-](C=C1)C=O.[Fe]

Isomeric SMILES

C1=C[C-](C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-].C1=C[C-](C=C1)C=O.[Fe]

InChI

InChI=1S/C13H10NO2.C6H5O.Fe/c15-14(16)13-9-7-12(8-10-13)6-5-11-3-1-2-4-11;7-5-6-3-1-2-4-6;/h1-10H;1-5H;/q2*-1;