(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 6-methoxy-2-phenyl-quinoline-4-carboxylate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 6-methoxy-2-phenyl-quinoline-4-carboxylate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 6-methoxy-2-phenyl-quinoline-4-carboxylate CAS Name: 6-methoxy-2-phenyl-4-quinolinecarboxylic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 6-methoxy-2-phenylquinoline-4-carboxylate Traditional Name: 6-methoxy-2-phenyl-cinchoninic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C23H19N3O4 MolecularWeight: 401.41466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=NC2=C1C=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=NC2=C1C=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H19N3O4/c1-14(25)19(12-24)22(27)13-30-23(28)18-11-21(15-6-4-3-5-7-15)26-20-9-8-16(29-2)10-17(18)20/h3-11,19,25H,13H2,1-2H3