2-methylcyclopenta-1,3-diene; methylidenezirconium; 4-oxidanylbenzenecarbonitrile; 1,2,3,5-tetramethylcyclopenta-1,3-diene

Systemtic Name: 2-methylcyclopenta-1,3-diene; methylidenezirconium; 4-oxidanylbenzenecarbonitrile; 1,2,3,5-tetramethylcyclopenta-1,3-diene Openeye Name: 4-hydroxybenzonitrile; 2-methylcyclopenta-1,3-diene; methylenezirconium; 1,2,3,5-tetramethylcyclopenta-1,3-diene CAS Name: 4-hydroxybenzonitrile; 2-methylcyclopenta-1,3-diene; methylenezirconium; 1,2,3,5-tetramethylcyclopenta-1,3-diene IUPAC Name: 4-hydroxybenzonitrile; 2-methylcyclopenta-1,3-diene; methylidenezirconium; 1,2,3,5-tetramethylcyclopenta-1,3-diene Traditional Name: 4-hydroxybenzonitrile; 2-methylcyclopenta-1,3-diene; methylenezirconium; 1,2,3,5-tetramethylcyclopenta-1,3-diene Formula: C30H32N2O2Zr-2 MolecularWeight: 543.81128

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Descriptors Computed from Structure

Canonical SMILES:

CC1[C-]=C(C(=C1C)C)C.CC1=CC[C-]=C1.C=[Zr].C1=CC(=CC=C1C#N)O.C1=CC(=CC=C1C#N)O

Isomeric SMILES

CC1[C-]=C(C(=C1C)C)C.CC1=CC[C-]=C1.C=[Zr].C1=CC(=CC=C1C#N)O.C1=CC(=CC=C1C#N)O

InChI

InChI=1S/C9H13.2C7H5NO.C6H7.CH2.Zr/c1-6-5-7(2)9(4)8(6)3;2*8-5-6-1-3-7(9)4-2-6;1-6-4-2-3-5-6;;/h6H,1-4H3;2*1-4,9H;4-5H,2H2,1H3;1H2;/q-1;;;-1;;