1,3-bis(3-ethylhexan-3-yl)-5-methyl-5-phenyl-1,3,5-diazaphosphinane-1,3,5-triium

Systemtic Name: 1,3-bis(3-ethylhexan-3-yl)-5-methyl-5-phenyl-1,3,5-diazaphosphinane-1,3,5-triium Openeye Name: 1,3-bis(1,1-diethylbutyl)-5-methyl-5-phenyl-1,3,5-diazaphosphinane-1,3,5-triium CAS Name: 1,3-bis(3-ethylhexan-3-yl)-5-methyl-5-phenyl-1,3,5-diazaphosphorinane-1,3,5-triium IUPAC Name: 1,3-bis(3-ethylhexan-3-yl)-5-methyl-5-phenyl-1,3,5-diazaphosphinane-1,3,5-triium Traditional Name: 1,3-bis(1,1-diethylbutyl)-5-methyl-5-phenyl-1,3,5-diazaphosphorinane-1,3,5-triium Formula: C26H50N2P+3 MolecularWeight: 421.662361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(CC)[NH+]1C[NH+](C[P+](C1)(C)C2=CC=CC=C2)C(CC)(CC)CCC

Isomeric SMILES

CCCC(CC)(CC)[NH+]1C[NH+](C[P+](C1)(C)C2=CC=CC=C2)C(CC)(CC)CCC

InChI

InChI=1S/C26H48N2P/c1-8-19-25(10-3,11-4)27-21-28(26(12-5,13-6)20-9-2)23-29(7,22-27)24-17-15-14-16-18-24/h14-18H,8-13,19-23H2,1-7H3/q+1/p+2