(E)-2-cyano-3-(3-oxidanylquinolin-4-yl)prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-(3-oxidanylquinolin-4-yl)prop-2-enoic acid Openeye Name: (E)-2-cyano-3-(3-hydroxy-4-quinolyl)prop-2-enoic acid CAS Name: (E)-2-cyano-3-(3-hydroxy-4-quinolinyl)-2-propenoic acid IUPAC Name: (E)-2-cyano-3-(3-hydroxyquinolin-4-yl)prop-2-enoic acid Traditional Name: (E)-2-cyano-3-(3-hydroxy-4-quinolyl)acrylic acid Formula: C13H8N2O3 MolecularWeight: 240.21422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)O)C=C(C#N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)O)/C=C(\C#N)/C(=O)O

InChI

InChI=1S/C13H8N2O3/c14-6-8(13(17)18)5-10-9-3-1-2-4-11(9)15-7-12(10)16/h1-5,7,16H,(H,17,18)/b8-5+