[5-ethoxy-2-(3-ethoxy-3-oxidanylidene-propyl)-4-methoxy-phenyl]methyl-triphenyl-phosphanium chloride

Systemtic Name: [5-ethoxy-2-(3-ethoxy-3-oxidanylidene-propyl)-4-methoxy-phenyl]methyl-triphenyl-phosphanium chloride Openeye Name: [5-ethoxy-2-(3-ethoxy-3-oxo-propyl)-4-methoxy-phenyl]methyl-triphenyl-phosphonium chloride CAS Name: [5-ethoxy-2-(3-ethoxy-3-oxopropyl)-4-methoxyphenyl]methyl-triphenylphosphonium chloride IUPAC Name: [5-ethoxy-2-(3-ethoxy-3-oxopropyl)-4-methoxyphenyl]methyl-triphenylphosphanium chloride Traditional Name: [5-ethoxy-2-(3-ethoxy-3-keto-propyl)-4-methoxy-benzyl]-triphenyl-phosphonium chloride Formula: C33H36ClO4P MolecularWeight: 563.063301

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CCC(=O)OCC)OC.[Cl-]

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CCC(=O)OCC)OC.[Cl-]

InChI

InChI=1S/C33H36O4P.ClH/c1-4-36-32-24-27(26(23-31(32)35-3)21-22-33(34)37-5-2)25-38(28-15-9-6-10-16-28,29-17-11-7-12-18-29)30-19-13-8-14-20-30;/h6-20,23-24H,4-5,21-22,25H2,1-3H3;1H/q+1;/p-1