3-[[3-(1-ethyl-2-oxidanyl-4-oxidanylidene-3H-quinolin-1-ium-3-yl)-5-oxidanylidene-1H-pyrazol-4-ylidene]methylidene]-1H-1,8-naphthyridine-2,4-dione

Systemtic Name: 3-[[3-(1-ethyl-2-oxidanyl-4-oxidanylidene-3H-quinolin-1-ium-3-yl)-5-oxidanylidene-1H-pyrazol-4-ylidene]methylidene]-1H-1,8-naphthyridine-2,4-dione Openeye Name: 3-[[3-(1-ethyl-2-hydroxy-4-oxo-3H-quinolin-1-ium-3-yl)-5-oxo-1H-pyrazol-4-ylidene]methylene]-1H-1,8-naphthyridine-2,4-dione CAS Name: 3-[[3-(1-ethyl-2-hydroxy-4-oxo-3H-quinolin-1-ium-3-yl)-5-oxo-1H-pyrazol-4-ylidene]methylidene]-1H-1,8-naphthyridine-2,4-dione IUPAC Name: 3-[[3-(1-ethyl-2-hydroxy-4-oxo-3H-quinolin-1-ium-3-yl)-5-oxo-1H-pyrazol-4-ylidene]methylidene]-1H-1,8-naphthyridine-2,4-dione Traditional Name: 3-[[3-(1-ethyl-2-hydroxy-4-keto-3H-quinolin-1-ium-3-yl)-5-keto-2-pyrazolin-4-ylidene]methylene]-1H-1,8-naphthyridine-2,4-quinone Formula: C23H16N5O5+ MolecularWeight: 442.40364

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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=C(NC4=O)N=CC=C5)O

Isomeric SMILES

CC[N+]1=C(C(C(=O)C2=CC=CC=C21)C3=NNC(=O)C3=C=C4C(=O)C5=C(NC4=O)N=CC=C5)O

InChI

InChI=1S/C23H15N5O5/c1-2-28-15-8-4-3-6-11(15)19(30)16(23(28)33)17-13(22(32)27-26-17)10-14-18(29)12-7-5-9-24-20(12)25-21(14)31/h3-9,16H,2H2,1H3,(H2,24,25,27,29,31,32)/p+1