[(E)-1-cyano-2-[(4-methylphenyl)amino]ethenyl]-triphenyl-phosphanium iodide

Systemtic Name: [(E)-1-cyano-2-[(4-methylphenyl)amino]ethenyl]-triphenyl-phosphanium iodide Openeye Name: [(E)-1-cyano-2-(4-methylanilino)vinyl]-triphenyl-phosphonium iodide CAS Name: [(E)-1-cyano-2-(4-methylanilino)ethenyl]-triphenylphosphonium iodide IUPAC Name: [(E)-1-cyano-2-(4-methylanilino)ethenyl]-triphenylphosphanium iodide Traditional Name: [(E)-1-cyano-2-(p-toluidino)vinyl]-triphenyl-phosphonium iodide Formula: C28H24IN2P MolecularWeight: 546.381791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC=C(C#N)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)N/C=C(\C#N)/[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]

InChI

InChI=1S/C28H24N2P.HI/c1-23-17-19-24(20-18-23)30-22-28(21-29)31(25-11-5-2-6-12-25,26-13-7-3-8-14-26)27-15-9-4-10-16-27;/h2-20,22,30H,1H3;1H/q+1;/p-1/b28-22+;