(5-chloranyl-1-benzothiophen-2-yl)methyl-triphenyl-phosphanium

Systemtic Name: (5-chloranyl-1-benzothiophen-2-yl)methyl-triphenyl-phosphanium Openeye Name: (5-chlorobenzothiophen-2-yl)methyl-triphenyl-phosphonium CAS Name: (5-chloro-1-benzothiophen-2-yl)methyl-triphenylphosphonium IUPAC Name: (5-chloro-1-benzothiophen-2-yl)methyl-triphenylphosphanium Traditional Name: (5-chlorobenzothiophen-2-yl)methyl-triphenyl-phosphonium Formula: C27H21ClPS+ MolecularWeight: 443.947401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC3=C(S2)C=CC(=C3)Cl)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC3=C(S2)C=CC(=C3)Cl)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H21ClPS/c28-22-16-17-27-21(18-22)19-26(30-27)20-29(23-10-4-1-5-11-23,24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-19H,20H2/q+1