[(2S)-2-acetamido-3-methyl-butyl] 2-diphenylphosphanylcyclopentane-1-carboxylate; ruthenium(2+)

Systemtic Name: [(2S)-2-acetamido-3-methyl-butyl] 2-diphenylphosphanylcyclopentane-1-carboxylate; ruthenium(2+) Openeye Name: [(2S)-2-acetamido-3-methyl-butyl] 2-diphenylphosphanylcyclopentanecarboxylate; ruthenium(2+) CAS Name: 2-diphenylphosphino-1-cyclopentanecarboxylic acid [(2S)-2-acetamido-3-methylbutyl] ester; ruthenium(2+) IUPAC Name: [(2S)-2-acetamido-3-methylbutyl] 2-diphenylphosphanylcyclopentane-1-carboxylate; ruthenium(2+) Traditional Name: 2-diphenylphosphinocyclopentanecarboxylic acid [(2S)-2-acetamido-3-methyl-butyl] ester; ruthenium(2+) Formula: C50H54N2O6P2Ru+2 MolecularWeight: 941.991082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C.CC(C)C(COC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C.[Ru+2]

Isomeric SMILES

CC(C)[C@@H](COC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C.CC(C)[C@@H](COC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C.[Ru+2]

InChI

InChI=1S/2C25H27NO3P.Ru/c2*1-18(2)23(26-19(3)27)17-29-25(28)22-15-10-16-24(22)30(20-11-6-4-7-12-20)21-13-8-5-9-14-21;/h2*4-16,18,23H,17H2,1-3H3,(H,26,27);/q;;+2/t2*23-;/m11./s1