[(3-ethanoylphenyl)-methyl-amino]-triphenyl-phosphanium iodide

Systemtic Name: [(3-ethanoylphenyl)-methyl-amino]-triphenyl-phosphanium iodide Openeye Name: (3-acetyl-N-methyl-anilino)-triphenyl-phosphonium iodide CAS Name: (3-acetyl-N-methylanilino)-triphenylphosphonium iodide IUPAC Name: (3-acetyl-N-methylanilino)-triphenylphosphanium iodide Traditional Name: (3-acetyl-N-methyl-anilino)-triphenyl-phosphonium iodide Formula: C27H25INOP MolecularWeight: 537.371731

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(C)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(C)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C27H25NOP.HI/c1-22(29)23-13-12-14-24(21-23)28(2)30(25-15-6-3-7-16-25,26-17-8-4-9-18-26)27-19-10-5-11-20-27;/h3-21H,1-2H3;1H/q+1;/p-1