1-ethyl-3-[[3-(1-ethyl-2-oxidanyl-4-oxidanylidene-3H-quinolin-1-ium-3-yl)-5-oxidanylidene-1H-pyrazol-4-ylidene]methylidene]-2-oxidanyl-quinolin-1-ium-4-one

Systemtic Name: 1-ethyl-3-[[3-(1-ethyl-2-oxidanyl-4-oxidanylidene-3H-quinolin-1-ium-3-yl)-5-oxidanylidene-1H-pyrazol-4-ylidene]methylidene]-2-oxidanyl-quinolin-1-ium-4-one Openeye Name: 1-ethyl-3-[[3-(1-ethyl-2-hydroxy-4-oxo-3H-quinolin-1-ium-3-yl)-5-oxo-1H-pyrazol-4-ylidene]methylene]-2-hydroxy-quinolin-1-ium-4-one CAS Name: 1-ethyl-3-[[3-(1-ethyl-2-hydroxy-4-oxo-3H-quinolin-1-ium-3-yl)-5-oxo-1H-pyrazol-4-ylidene]methylidene]-2-hydroxy-4-quinolin-1-iumone IUPAC Name: 1-ethyl-3-[[3-(1-ethyl-2-hydroxy-4-oxo-3H-quinolin-1-ium-3-yl)-5-oxo-1H-pyrazol-4-ylidene]methylidene]-2-hydroxyquinolin-1-ium-4-one Traditional Name: 1-ethyl-3-[[3-(1-ethyl-2-hydroxy-4-keto-3H-quinolin-1-ium-3-yl)-5-keto-2-pyrazolin-4-ylidene]methylene]-2-hydroxy-quinolin-1-ium-4-one Formula: C26H22N4O5+2 MolecularWeight: 470.47668

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C(C(=O)C2=CC=CC=C21)C3=NNC(=O)C3=C=C4C(=O)C5=CC=CC=C5[N+](=C4O)CC)O

Isomeric SMILES

CC[N+]1=C(C(C(=O)C2=CC=CC=C21)C3=NNC(=O)C3=C=C4C(=O)C5=CC=CC=C5[N+](=C4O)CC)O

InChI

InChI=1S/C26H20N4O5/c1-3-29-18-11-7-5-9-14(18)22(31)17(25(29)34)13-16-21(27-28-24(16)33)20-23(32)15-10-6-8-12-19(15)30(4-2)26(20)35/h5-12,20H,3-4H2,1-2H3,(H,28,33)/p+2