ethanol; 2-methanidylpropan-2-ylbenzene; zirconium

Systemtic Name: ethanol; 2-methanidylpropan-2-ylbenzene; zirconium Openeye Name: ethanol; (1-methanidyl-1-methyl-ethyl)benzene; zirconium CAS Name: ethanol; 2-methanidylpropan-2-ylbenzene; zirconium IUPAC Name: ethanol; 2-methanidylpropan-2-ylbenzene; zirconium Traditional Name: ethanol; (1-methanidyl-1-methyl-ethyl)benzene; zirconium Formula: C16H31O3Zr- MolecularWeight: 362.63954

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CCO.CCO.CC(C)([CH2-])C1=CC=CC=C1.[Zr]

Isomeric SMILES

CCO.CCO.CCO.CC(C)([CH2-])C1=CC=CC=C1.[Zr]

InChI

InChI=1S/C10H13.3C2H6O.Zr/c1-10(2,3)9-7-5-4-6-8-9;3*1-2-3;/h4-8H,1H2,2-3H3;3*3H,2H2,1H3;/q-1;;;;