(3-ethyl-2-oxidanylidene-heptyl)-triphenyl-phosphanium chloride

Systemtic Name: (3-ethyl-2-oxidanylidene-heptyl)-triphenyl-phosphanium chloride Openeye Name: (3-ethyl-2-oxo-heptyl)-triphenyl-phosphonium chloride CAS Name: (3-ethyl-2-oxoheptyl)-triphenylphosphonium chloride IUPAC Name: (3-ethyl-2-oxoheptyl)-triphenylphosphanium chloride Traditional Name: (3-ethyl-2-keto-heptyl)-triphenyl-phosphonium chloride Formula: C27H32ClOP MolecularWeight: 438.969141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCCCC(CC)C(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C27H32OP.ClH/c1-3-5-15-23(4-2)27(28)22-29(24-16-9-6-10-17-24,25-18-11-7-12-19-25)26-20-13-8-14-21-26;/h6-14,16-21,23H,3-5,15,22H2,1-2H3;1H/q+1;/p-1