2-[(4E)-4-[(4-methylsulfanylphenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]ethanoate

Systemtic Name: 2-[(4E)-4-[(4-methylsulfanylphenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]ethanoate Openeye Name: 2-[(4E)-4-[(4-methylsulfanylphenyl)methylene]-1,3-dioxo-2-isoquinolyl]acetate CAS Name: 2-[(4E)-4-[[4-(methylthio)phenyl]methylidene]-1,3-dioxo-2-isoquinolinyl]acetate IUPAC Name: 2-[(4E)-4-[(4-methylsulfanylphenyl)methylidene]-1,3-dioxoisoquinolin-2-yl]acetate Traditional Name: 2-[(4E)-1,3-diketo-4-[4-(methylthio)benzylidene]-2-isoquinolyl]acetate Formula: C19H14NO4S- MolecularWeight: 352.38376

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)CC(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/2\C3=CC=CC=C3C(=O)N(C2=O)CC(=O)[O-]

InChI

InChI=1S/C19H15NO4S/c1-25-13-8-6-12(7-9-13)10-16-14-4-2-3-5-15(14)18(23)20(19(16)24)11-17(21)22/h2-10H,11H2,1H3,(H,21,22)/p-1/b16-10+