7-methyl-1-(4-methylphenyl)-4-oxidanylidene-3-phenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate

Systemtic Name: 7-methyl-1-(4-methylphenyl)-4-oxidanylidene-3-phenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate Openeye Name: 7-methyl-4-oxo-3-phenyl-1-(p-tolyl)pyrimido[1,2-b]pyridazin-5-ium-2-olate CAS Name: 7-methyl-1-(4-methylphenyl)-4-oxo-3-phenyl-2-pyrimido[1,2-b]pyridazin-5-iumolate IUPAC Name: 7-methyl-1-(4-methylphenyl)-4-oxo-3-phenylpyrimido[1,2-b]pyridazin-5-ium-2-olate Traditional Name: 4-keto-7-methyl-3-phenyl-1-(p-tolyl)pyrimido[1,2-b]pyridazin-5-ium-2-olate Formula: C21H17N3O2 MolecularWeight: 343.37858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=[N+](C(=O)C(=C2[O-])C4=CC=CC=C4)N=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=[N+](C(=O)C(=C2[O-])C4=CC=CC=C4)N=C(C=C3)C

InChI

InChI=1S/C21H17N3O2/c1-14-8-11-17(12-9-14)23-18-13-10-15(2)22-24(18)21(26)19(20(23)25)16-6-4-3-5-7-16/h3-13H,1-2H3