[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]methyl-triphenyl-phosphanium chloride

Systemtic Name: [4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]methyl-triphenyl-phosphanium chloride Openeye Name: [4-(2-oxochromen-3-yl)thiazol-2-yl]methyl-triphenyl-phosphonium chloride CAS Name: [4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]methyl-triphenylphosphonium chloride IUPAC Name: [4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]methyl-triphenylphosphanium chloride Traditional Name: [4-(2-ketochromen-3-yl)thiazol-2-yl]methyl-triphenyl-phosphonium chloride Formula: C31H23ClNO2PS MolecularWeight: 540.011581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O)(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O)(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-]

InChI

InChI=1S/C31H23NO2PS.ClH/c33-31-27(20-23-12-10-11-19-29(23)34-31)28-22-36-30(32-28)21-35(24-13-4-1-5-14-24,25-15-6-2-7-16-25)26-17-8-3-9-18-26;/h1-20,22H,21H2;1H/q+1;/p-1