cyclopentane; 3-ethoxy-3-$l^{1}-oxidanyl-propanenitrile; ruthenium(2+); triphenylphosphane

Systemtic Name: cyclopentane; 3-ethoxy-3-$l^{1}-oxidanyl-propanenitrile; ruthenium(2+); triphenylphosphane Openeye Name: cyclopentane; 3-ethoxy-3-$l^{1}-oxidanyl-propanenitrile; ruthenium(2+); triphenylphosphane CAS Name: cyclopentane; 3-ethoxy-3-$l^{1}-oxidanylpropanenitrile; ruthenium(2+); triphenylphosphine IUPAC Name: cyclopentane; 3-ethoxy-3-$l^{1}-oxidanylpropanenitrile; ruthenium(2+); triphenylphosphane Traditional Name: cyclopentane; 3-ethoxy-3-$l^{1}-oxidanyl-propionitrile; ruthenium(2+); triphenylphosphine Formula: C46H41NO2P2Ru+2 MolecularWeight: 802.840762

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Descriptors Computed from Structure

Canonical SMILES:

CCO[C]([CH]C#N)[O].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Ru+2]

Isomeric SMILES

CCO[C]([CH]C#N)[O].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[CH]1[CH][CH][CH][CH]1.[Ru+2]

InChI

InChI=1S/2C18H15P.C5H6NO2.C5H5.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-8-5(7)3-4-6;1-2-4-5-3-1;/h2*1-15H;3H,2H2,1H3;1-5H;/q;;;;+2