4,5-bis(2-phenoxyethoxy)-2-phenyl-4H-pyridazin-2-ium-3-one

Systemtic Name: 4,5-bis(2-phenoxyethoxy)-2-phenyl-4H-pyridazin-2-ium-3-one Openeye Name: 4,5-bis(2-phenoxyethoxy)-2-phenyl-4H-pyridazin-2-ium-3-one CAS Name: 4,5-bis(2-phenoxyethoxy)-2-phenyl-4H-pyridazin-2-ium-3-one IUPAC Name: 4,5-bis(2-phenoxyethoxy)-2-phenyl-4H-pyridazin-2-ium-3-one Traditional Name: 4,5-bis(2-phenoxyethoxy)-2-phenyl-4H-pyridazin-2-ium-3-one Formula: C26H25N2O5+ MolecularWeight: 445.4871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=NC=C(C(C2=O)OCCOC3=CC=CC=C3)OCCOC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=NC=C(C(C2=O)OCCOC3=CC=CC=C3)OCCOC4=CC=CC=C4

InChI

InChI=1S/C26H25N2O5/c29-26-25(33-19-17-31-23-14-8-3-9-15-23)24(20-27-28(26)21-10-4-1-5-11-21)32-18-16-30-22-12-6-2-7-13-22/h1-15,20,25H,16-19H2/q+1