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

Systemtic Name: 3-[(4Z)-4-[(3-nitrophenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-[(3-nitrophenyl)methylene]-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-4-[(3-nitrophenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-4-[(3-nitrophenyl)methylidene]-1,3-dioxoisoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-1,3-diketo-4-(3-nitrobenzylidene)-2-isoquinolyl]propionate Formula: C19H13N2O6- MolecularWeight: 365.31632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=CC(=CC=C3)[N+](=O)[O-])C(=O)N(C2=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/C(=O)N(C2=O)CCC(=O)[O-]

InChI

InChI=1S/C19H14N2O6/c22-17(23)8-9-20-18(24)15-7-2-1-6-14(15)16(19(20)25)11-12-4-3-5-13(10-12)21(26)27/h1-7,10-11H,8-9H2,(H,22,23)/p-1/b16-11-