2-[(2-methoxycarbonylphenyl)amino]prop-2-enyl-triphenyl-phosphanium bromide

Systemtic Name: 2-[(2-methoxycarbonylphenyl)amino]prop-2-enyl-triphenyl-phosphanium bromide Openeye Name: 2-(2-methoxycarbonylanilino)allyl-triphenyl-phosphonium bromide CAS Name: 2-(2-methoxycarbonylanilino)prop-2-enyl-triphenylphosphonium bromide IUPAC Name: 2-(2-methoxycarbonylanilino)prop-2-enyl-triphenylphosphanium bromide Traditional Name: 2-(2-carbomethoxyanilino)allyl-triphenyl-phosphonium bromide Formula: C29H27BrNO2P MolecularWeight: 532.407941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C29H26NO2P.BrH/c1-23(30-28-21-13-12-20-27(28)29(31)32-2)22-33(24-14-6-3-7-15-24,25-16-8-4-9-17-25)26-18-10-5-11-19-26;/h3-21H,1,22H2,2H3;1H