cyclopentane; 5-[(E)-2-methylpent-1-enyl]-3-propyl-furan-2-ol; oxolane; tetraphenylboranuide; zirconium

Systemtic Name: cyclopentane; 5-[(E)-2-methylpent-1-enyl]-3-propyl-furan-2-ol; oxolane; tetraphenylboranuide; zirconium Openeye Name: cyclopentane; 5-[(E)-2-methylpent-1-enyl]-3-propyl-furan-2-ol; tetrahydrofuran; tetraphenylboranuide; zirconium CAS Name: cyclopentane; 5-[(E)-2-methylpent-1-enyl]-3-propyl-2-furanol; oxolane; tetraphenylboranuide; zirconium IUPAC Name: cyclopentane; 5-[(E)-2-methylpent-1-enyl]-3-propylfuran-2-ol; oxolane; tetraphenylboranuide; zirconium Traditional Name: cyclopentane; 5-[(E)-2-methylpent-1-enyl]-3-propyl-furan-2-ol; tetrahydrofuran; tetraphenylboranuide; zirconium Formula: C51H58BO3Zr- MolecularWeight: 821.03942

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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.CCCC1=C(OC(=C1)C=C(C)CCC)O.C1CCOC1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr]

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CCCC1=C(OC(=C1)/C=C(\C)/CCC)O.C1CCOC1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr]

InChI

InChI=1S/C24H20B.C13H20O2.2C5H5.C4H8O.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;1-4-6-10(3)8-12-9-11(7-5-2)13(14)15-12;3*1-2-4-5-3-1;/h1-20H;8-9,14H,4-7H2,1-3H3;2*1-5H;1-4H2;/q-1;;;;;/b;10-8+;;;;