ethyl 5-cyano-6-oxidanylidene-1-phenyl-4-[(E)-2-phenylethenyl]pyridazine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-oxidanylidene-1-phenyl-4-[(E)-2-phenylethenyl]pyridazine-3-carboxylate Openeye Name: ethyl 5-cyano-6-oxo-1-phenyl-4-[(E)-styryl]pyridazine-3-carboxylate CAS Name: 5-cyano-6-oxo-1-phenyl-4-[(E)-2-phenylethenyl]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-oxo-1-phenyl-4-[(E)-2-phenylethenyl]pyridazine-3-carboxylate Traditional Name: 5-cyano-6-keto-1-phenyl-4-[(E)-styryl]pyridazine-3-carboxylic acid ethyl ester Formula: C22H17N3O3 MolecularWeight: 371.38868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C(=C1C=CC2=CC=CC=C2)C#N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C(=C1/C=C/C2=CC=CC=C2)C#N)C3=CC=CC=C3

InChI

InChI=1S/C22H17N3O3/c1-2-28-22(27)20-18(14-13-16-9-5-3-6-10-16)19(15-23)21(26)25(24-20)17-11-7-4-8-12-17/h3-14H,2H2,1H3/b14-13+