3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate

Systemtic Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylene]-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-4-[(4-dimethylaminophenyl)methylidene]-1,3-dioxoisoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-4-[4-(dimethylamino)benzylidene]-1,3-diketo-2-isoquinolyl]propionate Formula: C21H19N2O4- MolecularWeight: 363.38656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O4/c1-22(2)15-9-7-14(8-10-15)13-18-16-5-3-4-6-17(16)20(26)23(21(18)27)12-11-19(24)25/h3-10,13H,11-12H2,1-2H3,(H,24,25)/p-1/b18-13-