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

Systemtic Name: 4-oxidanylidene-1,7-diphenyl-3-(phenylmethyl)pyrimido[1,2-b]pyridazin-5-ium-2-olate Openeye Name: 3-benzyl-4-oxo-1,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate CAS Name: 4-oxo-1,7-diphenyl-3-(phenylmethyl)-2-pyrimido[1,2-b]pyridazin-5-iumolate IUPAC Name: 3-benzyl-4-oxo-1,7-diphenylpyrimido[1,2-b]pyridazin-5-ium-2-olate Traditional Name: 3-benzyl-4-keto-1,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-2-olate Formula: C26H19N3O2 MolecularWeight: 405.44796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N(C3=[N+](C2=O)N=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C5)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N(C3=[N+](C2=O)N=C(C=C3)C4=CC=CC=C4)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C26H19N3O2/c30-25-22(18-19-10-4-1-5-11-19)26(31)29-24(28(25)21-14-8-3-9-15-21)17-16-23(27-29)20-12-6-2-7-13-20/h1-17H,18H2