3-ethyl-2-oxidanyl-1,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-4-one

Systemtic Name: 3-ethyl-2-oxidanyl-1,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-4-one Openeye Name: 3-ethyl-2-hydroxy-1,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-4-one CAS Name: 3-ethyl-2-hydroxy-1,7-diphenyl-4-pyrimido[1,2-b]pyridazin-5-iumone IUPAC Name: 3-ethyl-2-hydroxy-1,7-diphenylpyrimido[1,2-b]pyridazin-5-ium-4-one Traditional Name: 3-ethyl-2-hydroxy-1,7-diphenyl-pyrimido[1,2-b]pyridazin-5-ium-4-one Formula: C21H18N3O2+ MolecularWeight: 344.38652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C2=[N+](C1=O)N=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCC1=C(N(C2=[N+](C1=O)N=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C21H17N3O2/c1-2-17-20(25)23(16-11-7-4-8-12-16)19-14-13-18(22-24(19)21(17)26)15-9-5-3-6-10-15/h3-14H,2H2,1H3/p+1