(3-methylphenyl)-(2-oxidanylideneheptyl)-diphenyl-phosphanium chloride

Systemtic Name: (3-methylphenyl)-(2-oxidanylideneheptyl)-diphenyl-phosphanium chloride Openeye Name: m-tolyl-(2-oxoheptyl)-diphenyl-phosphonium chloride CAS Name: (3-methylphenyl)-(2-oxoheptyl)-diphenylphosphonium chloride IUPAC Name: (3-methylphenyl)-(2-oxoheptyl)-diphenylphosphanium chloride Traditional Name: 2-ketoheptyl-(m-tolyl)-diphenyl-phosphonium chloride Formula: C26H30ClOP MolecularWeight: 424.942561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H30OP.ClH/c1-3-4-7-14-23(27)21-28(24-15-8-5-9-16-24,25-17-10-6-11-18-25)26-19-12-13-22(2)20-26;/h5-6,8-13,15-20H,3-4,7,14,21H2,1-2H3;1H/q+1;/p-1