(1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene; (1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene; iron(2+)

Systemtic Name: (1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene; (1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene; iron(2+) Openeye Name: ferrous; (1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene; (1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene CAS Name: [1-(1-cyclopenta-1,3-dienyl)-1-methoxypent-4-en-2-ynyl]benzene; [1-(1-cyclopenta-1,3-dienyl)-1-methoxypent-4-en-2-ynyl]benzene; iron(2+) IUPAC Name: (1-cyclopenta-1,3-dien-1-yl-1-methoxypent-4-en-2-ynyl)benzene; (1-cyclopenta-1,3-dien-1-yl-1-methoxypent-4-en-2-ynyl)benzene; iron(2+) Traditional Name: ferrous; (1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene; (1-cyclopenta-1,3-dien-1-yl-1-methoxy-pent-4-en-2-ynyl)benzene Formula: C34H30FeO2 MolecularWeight: 526.4458

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Descriptors Computed from Structure

Canonical SMILES:

COC(C#CC=C)(C1=C[C-]=CC1)C2=CC=CC=C2.COC(C#CC=C)(C1=[C-]C=CC1)C2=CC=CC=C2.[Fe+2]

Isomeric SMILES

COC(C#CC=C)(C1=C[C-]=CC1)C2=CC=CC=C2.COC(C#CC=C)(C1=[C-]C=CC1)C2=CC=CC=C2.[Fe+2]

InChI

InChI=1S/2C17H15O.Fe/c2*1-3-4-14-17(18-2,16-12-8-9-13-16)15-10-6-5-7-11-15;/h3,5-8,10-11,13H,1,12H2,2H3;3,5-11H,1,12H2,2H3;/q2*-1;+2