4-oxidaniumylidenepentan-2-ylideneoxidanium; zirconium

Systemtic Name: 4-oxidaniumylidenepentan-2-ylideneoxidanium; zirconium Openeye Name: (1-methyl-3-oxoniumylidene-butylidene)oxonium; zirconium CAS Name: 4-oxoniumylidenepentan-2-ylideneoxonium; zirconium IUPAC Name: 4-oxoniumylidenepentan-2-ylideneoxidanium; zirconium Traditional Name: (1-methyl-3-oxoniumylidene-butylidene)oxonium; zirconium Formula: C20H40O8Zr+8 MolecularWeight: 499.7508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.[Zr]

Isomeric SMILES

CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.CC(=[OH+])CC(=[OH+])C.[Zr]

InChI

InChI=1S/4C5H8O2.Zr/c4*1-4(6)3-5(2)7;/h4*3H2,1-2H3;/p+8