5-methyl-5-phenyl-1,3-bis(2,2,3,3-tetramethylbutyl)-1,3,5-diazaphosphinan-5-ium iodide

Systemtic Name: 5-methyl-5-phenyl-1,3-bis(2,2,3,3-tetramethylbutyl)-1,3,5-diazaphosphinan-5-ium iodide Openeye Name: 5-methyl-5-phenyl-1,3-bis(2,2,3,3-tetramethylbutyl)-1,3,5-diazaphosphinan-5-ium iodide CAS Name: 5-methyl-5-phenyl-1,3-bis(2,2,3,3-tetramethylbutyl)-1,3,5-diazaphosphorinan-5-ium iodide IUPAC Name: 5-methyl-5-phenyl-1,3-bis(2,2,3,3-tetramethylbutyl)-1,3,5-diazaphosphinan-5-ium iodide Traditional Name: 5-methyl-5-phenyl-1,3-bis(2,2,3,3-tetramethylbutyl)-1,3,5-diazaphosphorinan-5-ium iodide Formula: C26H48IN2P MolecularWeight: 546.550951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C)(C)CN1CN(C[P+](C1)(C)C2=CC=CC=C2)CC(C)(C)C(C)(C)C.[I-]

Isomeric SMILES

CC(C)(C)C(C)(C)CN1CN(C[P+](C1)(C)C2=CC=CC=C2)CC(C)(C)C(C)(C)C.[I-]

InChI

InChI=1S/C26H48N2P.HI/c1-23(2,3)25(7,8)17-27-19-28(18-26(9,10)24(4,5)6)21-29(11,20-27)22-15-13-12-14-16-22;/h12-16H,17-21H2,1-11H3;1H/q+1;/p-1