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

Systemtic Name: 1-ethyl-3-[(4Z)-4-[(3-hydroxyphenyl)methylidene]-5-oxidanylidene-1H-pyrazol-3-yl]-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 1-ethyl-2-hydroxy-3-[(4Z)-4-[(3-hydroxyphenyl)methylene]-5-oxo-1H-pyrazol-3-yl]-3H-quinolin-1-ium-4-one CAS Name: 1-ethyl-2-hydroxy-3-[(4Z)-4-[(3-hydroxyphenyl)methylidene]-5-oxo-1H-pyrazol-3-yl]-3H-quinolin-1-ium-4-one IUPAC Name: 1-ethyl-2-hydroxy-3-[(4Z)-4-[(3-hydroxyphenyl)methylidene]-5-oxo-1H-pyrazol-3-yl]-3H-quinolin-1-ium-4-one Traditional Name: 1-ethyl-2-hydroxy-3-[(4Z)-4-(3-hydroxybenzylidene)-5-keto-2-pyrazolin-3-yl]-3H-quinolin-1-ium-4-one Formula: C21H18N3O4+ MolecularWeight: 376.38532

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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=CC4=CC(=CC=C4)O)O

Isomeric SMILES

CC[N+]1=C(C(C(=O)C2=CC=CC=C21)C\3=NNC(=O)/C3=C\C4=CC(=CC=C4)O)O

InChI

InChI=1S/C21H17N3O4/c1-2-24-16-9-4-3-8-14(16)19(26)17(21(24)28)18-15(20(27)23-22-18)11-12-6-5-7-13(25)10-12/h3-11,17H,2H2,1H3,(H2,23,25,27)/p+1/b15-11-