cyclopentane; ethanoyl-[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]azanide; tetraphenylboranuide; zirconium(4+)

Systemtic Name: cyclopentane; ethanoyl-[(2S)-1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl]azanide; tetraphenylboranuide; zirconium(4+) Openeye Name: acetyl-[(1S)-1-methoxycarbonyl-2-methyl-propyl]azanide; cyclopentane; tetraphenylboranuide; zirconium(4+) CAS Name: acetyl-[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]azanide; cyclopentane; tetraphenylboranuide; zirconium(4+) IUPAC Name: acetyl-[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]azanide; cyclopentane; tetraphenylboranuide; zirconium(4+) Traditional Name: acetyl-[(1S)-1-carbomethoxy-2-methyl-propyl]azanide; cyclopentane; tetraphenylboranuide; zirconium(4+) Formula: C42H44BNO3Zr+2 MolecularWeight: 712.83866

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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.CC(C)C(C(=O)OC)[N-]C(=O)C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC(C)[C@@H](C(=O)OC)[N-]C(=O)C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

InChI

InChI=1S/C24H20B.C8H15NO3.2C5H5.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;1-5(2)7(8(11)12-4)9-6(3)10;2*1-2-4-5-3-1;/h1-20H;5,7H,1-4H3,(H,9,10);2*1-5H;/q-1;;;;+4/p-1/t;7-;;;/m.0.../s1