(E)-4,4-bis[diethoxyphosphorylimino(diphenyl)-$l^{5}-phosphanyl]-1,1-diphenyl-but-2-en-1-ol; 1-methyl-4-propan-2-yl-cyclohexane; ruthenium(2+)

Systemtic Name: (E)-4,4-bis[diethoxyphosphorylimino(diphenyl)-$l^{5}-phosphanyl]-1,1-diphenyl-but-2-en-1-ol; 1-methyl-4-propan-2-yl-cyclohexane; ruthenium(2+) Openeye Name: (E)-4,4-bis[diethoxyphosphorylimino(diphenyl)-$l^{5}-phosphanyl]-1,1-diphenyl-but-2-en-1-ol; 1-isopropyl-4-methyl-cyclohexane; ruthenium(2+) CAS Name: (E)-4,4-bis[diethoxyphosphorylimino(diphenyl)phosphoranyl]-1,1-diphenyl-2-buten-1-ol; 1-methyl-4-propan-2-ylcyclohexane; ruthenium(2+) IUPAC Name: (E)-4,4-bis[diethoxyphosphorylimino(diphenyl)-$l^{5}-phosphanyl]-1,1-diphenylbut-2-en-1-ol; 1-methyl-4-propan-2-ylcyclohexane; ruthenium(2+) Traditional Name: (E)-4,4-bis[diethoxyphosphorylimino(diphenyl)phosphoranyl]-1,1-diphenyl-but-2-en-1-ol; 1-isopropyl-4-methyl-cyclohexane; ruthenium(2+) Formula: C58H66N2O7P4Ru MolecularWeight: 1128.118884

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(N=P(C1=CC=CC=C1)(C2=CC=CC=C2)[C-](C=CC(C3=CC=CC=C3)(C4=CC=CC=C4)O)P(=NP(=O)(OCC)OCC)(C5=CC=CC=C5)C6=C[C-]=CC=C6)OCC.C[C]1[CH][CH][C]([CH][CH]1)C(C)C.[Ru+2]

Isomeric SMILES

CCOP(=O)(N=P(C1=CC=CC=C1)(C2=CC=CC=C2)[C-](/C=C/C(C3=CC=CC=C3)(C4=CC=CC=C4)O)P(=NP(=O)(OCC)OCC)(C5=CC=CC=C5)C6=C[C-]=CC=C6)OCC.C[C]1[CH][CH][C]([CH][CH]1)C(C)C.[Ru+2]

InChI

InChI=1S/C48H52N2O7P4.C10H14.Ru/c1-5-54-60(52,55-6-2)49-58(43-31-19-11-20-32-43,44-33-21-12-22-34-44)47(39-40-48(51,41-27-15-9-16-28-41)42-29-17-10-18-30-42)59(45-35-23-13-24-36-45,46-37-25-14-26-38-46)50-61(53,56-7-3)57-8-4;1-8(2)10-6-4-9(3)5-7-10;/h9-25,27-40,51H,5-8H2,1-4H3;4-8H,1-3H3;/q-2;;+2/b40-39+;;