(4Z)-5-methyl-4-[(2-morpholin-4-ylquinolin-1-ium-3-yl)methylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-4-[(2-morpholin-4-ylquinolin-1-ium-3-yl)methylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-5-methyl-4-[(2-morpholinoquinolin-1-ium-3-yl)methylene]-2-phenyl-pyrazol-3-one CAS Name: (4Z)-5-methyl-4-[[2-(4-morpholinyl)-3-quinolin-1-iumyl]methylidene]-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-5-methyl-4-[(2-morpholin-4-ylquinolin-1-ium-3-yl)methylidene]-2-phenylpyrazol-3-one Traditional Name: (4Z)-5-methyl-4-[(2-morpholinoquinolin-1-ium-3-yl)methylene]-2-phenyl-2-pyrazolin-3-one Formula: C24H23N4O2+ MolecularWeight: 399.46502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC3=CC=CC=C3[NH+]=C2N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC3=CC=CC=C3[NH+]=C2N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C24H22N4O2/c1-17-21(24(29)28(26-17)20-8-3-2-4-9-20)16-19-15-18-7-5-6-10-22(18)25-23(19)27-11-13-30-14-12-27/h2-10,15-16H,11-14H2,1H3/p+1/b21-16-