lithium 1,3,5-tris(phenylmethyl)-1,3,5-triazinane-1,3,5-triium

Systemtic Name: lithium 1,3,5-tris(phenylmethyl)-1,3,5-triazinane-1,3,5-triium Openeye Name: lithium 1,3,5-tribenzyl-1,3,5-triazinane-1,3,5-triium CAS Name: lithium 1,3,5-tris(phenylmethyl)-1,3,5-triazinane-1,3,5-triium IUPAC Name: lithium 1,3,5-tribenzyl-1,3,5-triazinane-1,3,5-triium Traditional Name: lithium 1,3,5-tribenzyl-1,3,5-triazinane-1,3,5-triium Formula: C48H60LiN6+7 MolecularWeight: 727.9712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[Li+].C1[NH+](C[NH+](C[NH+]1CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4.C1[NH+](C[NH+](C[NH+]1CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

[Li+].C1[NH+](C[NH+](C[NH+]1CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4.C1[NH+](C[NH+](C[NH+]1CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/2C24H27N3.Li/c2*1-4-10-22(11-5-1)16-25-19-26(17-23-12-6-2-7-13-23)21-27(20-25)18-24-14-8-3-9-15-24;/h2*1-15H,16-21H2;/q;;+1/p+6