carbanide; 1-(2-cyclopentylpropan-2-yl)indene; oxolane; tetraphenylboranuide; zirconium(4+)

Systemtic Name: carbanide; 1-(2-cyclopentylpropan-2-yl)indene; oxolane; tetraphenylboranuide; zirconium(4+) Openeye Name: carbanide; 1-(1-cyclopentyl-1-methyl-ethyl)indene; tetrahydrofuran; tetraphenylboranuide; zirconium(4+) CAS Name: carbanide; 1-(2-cyclopentylpropan-2-yl)indene; oxolane; tetraphenylboranuide; zirconium(4+) IUPAC Name: carbanide; 1-(2-cyclopentylpropan-2-yl)indene; oxolane; tetraphenylboranuide; zirconium(4+) Traditional Name: carbanide; 1-(1-cyclopentyl-1-methyl-ethyl)indene; tetrahydrofuran; tetraphenylboranuide; zirconium(4+) Formula: C46H47BOZr+2 MolecularWeight: 717.89978

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[CH3-].CC(C)([C]1[CH][CH][CH][CH]1)[C]2[CH][CH][C]3[C]2C=CC=C3.C1CCOC1.[Zr+4]

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[CH3-].CC(C)([C]1[CH][CH][CH][CH]1)[C]2[CH][CH][C]3[C]2C=CC=C3.C1CCOC1.[Zr+4]

InChI

InChI=1S/C24H20B.C17H16.C4H8O.CH3.Zr/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-17(2,14-8-4-5-9-14)16-12-11-13-7-3-6-10-15(13)16;1-2-4-5-3-1;;/h1-20H;3-12H,1-2H3;1-4H2;1H3;/q-1;;;-1;+4