1-(3-methoxyphenyl)-4-oxidanylidene-3,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate

Systemtic Name: 1-(3-methoxyphenyl)-4-oxidanylidene-3,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate Openeye Name: 1-(3-methoxyphenyl)-4-oxo-3,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate CAS Name: 1-(3-methoxyphenyl)-4-oxo-3,7-diphenyl-2-pyrimido[1,2-b]pyridazin-5-iumolate IUPAC Name: 1-(3-methoxyphenyl)-4-oxo-3,7-diphenylpyrimido[1,2-b]pyridazin-5-ium-2-olate Traditional Name: 4-keto-1-(3-methoxyphenyl)-3,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate Formula: C26H19N3O3 MolecularWeight: 421.44736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C3=[N+](C(=O)C(=C2[O-])C4=CC=CC=C4)N=C(C=C3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)N2C3=[N+](C(=O)C(=C2[O-])C4=CC=CC=C4)N=C(C=C3)C5=CC=CC=C5

InChI

InChI=1S/C26H19N3O3/c1-32-21-14-8-13-20(17-21)28-23-16-15-22(18-9-4-2-5-10-18)27-29(23)26(31)24(25(28)30)19-11-6-3-7-12-19/h2-17H,1H3