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

Systemtic Name: 3-[(4Z)-1,3-bis(oxidanylidene)-4-(phenylmethylidene)isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-benzylidene-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-1,3-dioxo-4-(phenylmethylene)-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-4-benzylidene-1,3-dioxoisoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-4-benzal-1,3-diketo-2-isoquinolyl]propionate Formula: C19H14NO4- MolecularWeight: 320.31876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15NO4/c21-17(22)10-11-20-18(23)15-9-5-4-8-14(15)16(19(20)24)12-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22)/p-1/b16-12-