4-(4,6-diphenoxy-1,3,5-triazin-2-yl)-4-ethyl-morpholin-4-ium perchlorate

Systemtic Name: 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)-4-ethyl-morpholin-4-ium perchlorate Openeye Name: 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)-4-ethyl-morpholin-4-ium perchlorate CAS Name: 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)-4-ethylmorpholin-4-ium perchlorate IUPAC Name: 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)-4-ethylmorpholin-4-ium perchlorate Traditional Name: 4-(4,6-diphenoxy-s-triazin-2-yl)-4-ethyl-morpholin-4-ium perchlorate Formula: C21H23ClN4O7 MolecularWeight: 478.88292

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCOCC1)C2=NC(=NC(=N2)OC3=CC=CC=C3)OC4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC[N+]1(CCOCC1)C2=NC(=NC(=N2)OC3=CC=CC=C3)OC4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H23N4O3.ClHO4/c1-2-25(13-15-26-16-14-25)19-22-20(27-17-9-5-3-6-10-17)24-21(23-19)28-18-11-7-4-8-12-18;2-1(3,4)5/h3-12H,2,13-16H2,1H3;(H,2,3,4,5)/q+1;/p-1