2-(2-chloranyl-3-ethoxy-3-oxidanylidene-2-triphenylphosphaniumyl-propanoyl)benzoate

Systemtic Name: 2-(2-chloranyl-3-ethoxy-3-oxidanylidene-2-triphenylphosphaniumyl-propanoyl)benzoate Openeye Name: 2-(2-chloro-3-ethoxy-3-oxo-2-triphenylphosphaniumyl-propanoyl)benzoate CAS Name: 2-(2-chloro-3-ethoxy-1,3-dioxo-2-triphenylphosphiniumylpropyl)benzoate IUPAC Name: 2-(2-chloro-3-ethoxy-3-oxo-2-triphenylphosphaniumylpropanoyl)benzoate Traditional Name: 2-(2-chloro-3-ethoxy-3-keto-2-triphenylphosphiniumyl-propanoyl)benzoate Formula: C30H24ClO5P MolecularWeight: 530.935321

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C1=CC=CC=C1C(=O)[O-])([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C(C(=O)C1=CC=CC=C1C(=O)[O-])([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C30H24ClO5P/c1-2-36-29(35)30(31,27(32)25-20-12-13-21-26(25)28(33)34)37(22-14-6-3-7-15-22,23-16-8-4-9-17-23)24-18-10-5-11-19-24/h3-21H,2H2,1H3