butan-1-ol; 2-butylcyclopenta-1,3-diene; carbanide; zirconium(3+)

Systemtic Name: butan-1-ol; 2-butylcyclopenta-1,3-diene; carbanide; zirconium(3+) Openeye Name: butan-1-ol; 2-butylcyclopenta-1,3-diene; carbanide; zirconium(3+) CAS Name: 1-butanol; 2-butylcyclopenta-1,3-diene; carbanide; zirconium(3+) IUPAC Name: butan-1-ol; 2-butylcyclopenta-1,3-diene; carbanide; zirconium(3+) Traditional Name: butan-1-ol; 2-butylcyclopenta-1,3-diene; carbanide; zirconium(3+) Formula: C15H29OZr MolecularWeight: 316.61416

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].CCCCC1=[C-]CC=C1.CCCCO.[Zr+3]

Isomeric SMILES

[CH3-].[CH3-].CCCCC1=[C-]CC=C1.CCCCO.[Zr+3]

InChI

InChI=1S/C9H13.C4H10O.2CH3.Zr/c1-2-3-6-9-7-4-5-8-9;1-2-3-4-5;;;/h4,7H,2-3,5-6H2,1H3;5H,2-4H2,1H3;2*1H3;/q-1;;2*-1;+3