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

Systemtic Name: 1-ethyl-2-oxidanyl-3-[(4Z)-5-oxidanylidene-4-[(pyridin-2-ylamino)methylidene]-1H-pyrazol-3-yl]-3H-quinolin-1-ium-4-one Openeye Name: 1-ethyl-2-hydroxy-3-[(4Z)-5-oxo-4-[(2-pyridylamino)methylene]-1H-pyrazol-3-yl]-3H-quinolin-1-ium-4-one CAS Name: 1-ethyl-2-hydroxy-3-[(4Z)-5-oxo-4-[(2-pyridinylamino)methylidene]-1H-pyrazol-3-yl]-3H-quinolin-1-ium-4-one IUPAC Name: 1-ethyl-2-hydroxy-3-[(4Z)-5-oxo-4-[(pyridin-2-ylamino)methylidene]-1H-pyrazol-3-yl]-3H-quinolin-1-ium-4-one Traditional Name: 1-ethyl-2-hydroxy-3-[(4Z)-5-keto-4-[(2-pyridylamino)methylene]-2-pyrazolin-3-yl]-3H-quinolin-1-ium-4-one Formula: C20H18N5O3+ MolecularWeight: 376.38862

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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=CNC4=CC=CC=N4)O

Isomeric SMILES

CC[N+]1=C(C(C(=O)C2=CC=CC=C21)C\3=NNC(=O)/C3=C\NC4=CC=CC=N4)O

InChI

InChI=1S/C20H17N5O3/c1-2-25-14-8-4-3-7-12(14)18(26)16(20(25)28)17-13(19(27)24-23-17)11-22-15-9-5-6-10-21-15/h3-11,16H,2H2,1H3,(H2,21,22,23,24,27)/p+1