[3-[(E)-4-cyano-2-methyl-but-1-enyl]phenyl]methyl-triphenyl-phosphanium

Systemtic Name: [3-[(E)-4-cyano-2-methyl-but-1-enyl]phenyl]methyl-triphenyl-phosphanium Openeye Name: [3-[(E)-4-cyano-2-methyl-but-1-enyl]phenyl]methyl-triphenyl-phosphonium CAS Name: [3-[(E)-4-cyano-2-methylbut-1-enyl]phenyl]methyl-triphenylphosphonium IUPAC Name: [3-[(E)-4-cyano-2-methylbut-1-enyl]phenyl]methyl-triphenylphosphanium Traditional Name: [3-[(E)-4-cyano-2-methyl-but-1-enyl]benzyl]-triphenyl-phosphonium Formula: C31H29NP+ MolecularWeight: 446.542421

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=CC=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CCC#N

Isomeric SMILES

C/C(=C\C1=CC(=CC=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/CCC#N

InChI

InChI=1S/C31H29NP/c1-26(13-12-22-32)23-27-14-11-15-28(24-27)25-33(29-16-5-2-6-17-29,30-18-7-3-8-19-30)31-20-9-4-10-21-31/h2-11,14-21,23-24H,12-13,25H2,1H3/q+1/b26-23+