2-[2-(3-butan-2-yloxy-3-oxidanylidene-2-triphenylphosphaniumyl-propanoyl)phenyl]benzoate

Systemtic Name: 2-[2-(3-butan-2-yloxy-3-oxidanylidene-2-triphenylphosphaniumyl-propanoyl)phenyl]benzoate Openeye Name: 2-[2-(3-oxo-3-sec-butoxy-2-triphenylphosphaniumyl-propanoyl)phenyl]benzoate CAS Name: 2-[2-(3-butan-2-yloxy-1,3-dioxo-2-triphenylphosphiniumylpropyl)phenyl]benzoate IUPAC Name: 2-[2-(3-butan-2-yloxy-3-oxo-2-triphenylphosphaniumylpropanoyl)phenyl]benzoate Traditional Name: 2-[2-(3-keto-3-sec-butoxy-2-triphenylphosphiniumyl-propanoyl)phenyl]benzoate Formula: C38H33O5P MolecularWeight: 600.639381

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C(C(=O)C1=CC=CC=C1C2=CC=CC=C2C(=O)[O-])[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C)OC(=O)C(C(=O)C1=CC=CC=C1C2=CC=CC=C2C(=O)[O-])[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C38H33O5P/c1-3-27(2)43-38(42)36(35(39)33-25-15-13-23-31(33)32-24-14-16-26-34(32)37(40)41)44(28-17-7-4-8-18-28,29-19-9-5-10-20-29)30-21-11-6-12-22-30/h4-27,36H,3H2,1-2H3