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

Systemtic Name: 3-[(4Z)-4-[(4-methoxy-3-propoxy-phenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-[(4-methoxy-3-propoxy-phenyl)methylene]-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-4-[(4-methoxy-3-propoxyphenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-4-[(4-methoxy-3-propoxyphenyl)methylidene]-1,3-dioxoisoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-1,3-diketo-4-(4-methoxy-3-propoxy-benzylidene)-2-isoquinolyl]propionate Formula: C23H22NO6- MolecularWeight: 408.42388

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)CCC(=O)[O-])OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)/C=C\2/C3=CC=CC=C3C(=O)N(C2=O)CCC(=O)[O-])OC

InChI

InChI=1S/C23H23NO6/c1-3-12-30-20-14-15(8-9-19(20)29-2)13-18-16-6-4-5-7-17(16)22(27)24(23(18)28)11-10-21(25)26/h4-9,13-14H,3,10-12H2,1-2H3,(H,25,26)/p-1/b18-13-