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

Systemtic Name: 3-[(4Z)-4-[(4-methoxycarbonylphenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-[(4-methoxycarbonylphenyl)methylene]-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-4-[(4-methoxycarbonylphenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-4-[(4-methoxycarbonylphenyl)methylidene]-1,3-dioxoisoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-4-(4-carbomethoxybenzylidene)-1,3-diketo-2-isoquinolyl]propionate Formula: C21H16NO6- MolecularWeight: 378.35484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17NO6/c1-28-21(27)14-8-6-13(7-9-14)12-17-15-4-2-3-5-16(15)19(25)22(20(17)26)11-10-18(23)24/h2-9,12H,10-11H2,1H3,(H,23,24)/p-1/b17-12-