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

Systemtic Name: 3-[(4Z)-1,3-bis(oxidanylidene)-4-[(3-prop-2-enoxyphenyl)methylidene]isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-[(3-allyloxyphenyl)methylene]-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-1,3-dioxo-4-[(3-prop-2-enoxyphenyl)methylidene]-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-1,3-dioxo-4-[(3-prop-2-enoxyphenyl)methylidene]isoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-4-(3-allyloxybenzylidene)-1,3-diketo-2-isoquinolyl]propionate Formula: C22H18NO5- MolecularWeight: 376.38202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC(=C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)CCC(=O)[O-]

Isomeric SMILES

C=CCOC1=CC=CC(=C1)/C=C\2/C3=CC=CC=C3C(=O)N(C2=O)CCC(=O)[O-]

InChI

InChI=1S/C22H19NO5/c1-2-12-28-16-7-5-6-15(13-16)14-19-17-8-3-4-9-18(17)21(26)23(22(19)27)11-10-20(24)25/h2-9,13-14H,1,10-12H2,(H,24,25)/p-1/b19-14-