ethyl butanoate; nitric oxide; ruthenium(1+); triphenylphosphane

Systemtic Name: ethyl butanoate; nitric oxide; ruthenium(1+); triphenylphosphane Openeye Name: ethyl butanoate; nitric oxide; ruthenium(1+); triphenylphosphane CAS Name: butanoic acid ethyl ester; nitric oxide; ruthenium(1+); triphenylphosphine IUPAC Name: ethyl butanoate; nitric oxide; ruthenium(1+); triphenylphosphane Traditional Name: butyric acid ethyl ester; nitric oxide; ruthenium(1+); triphenylphosphine Formula: C42H39NO3P2Ru+ MolecularWeight: 768.781482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[CH][CH][CH2].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.[N]=O.[Ru+]

Isomeric SMILES

CCOC(=O)[CH][CH][CH2].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.[N]=O.[Ru+]

InChI

InChI=1S/2C18H15P.C6H9O2.NO.Ru/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-5-6(7)8-4-2;1-2;/h2*1-15H;3,5H,1,4H2,2H3;;/q;;;;+1