2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(3-ethoxy-4-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: 2-cyano-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3-(3-ethoxy-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3-(3-ethoxy-4-hydroxy-phenyl)prop-2-enamide CAS Name: 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3-(3-ethoxy-4-hydroxyphenyl)-2-propenamide IUPAC Name: 2-cyano-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enamide Traditional Name: 2-cyano-3-(3-ethoxy-4-hydroxy-phenyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acrylamide Formula: C23H22N4O4 MolecularWeight: 418.44518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)O

InChI

InChI=1S/C23H22N4O4/c1-4-31-20-13-16(10-11-19(20)28)12-17(14-24)22(29)25-21-15(2)26(3)27(23(21)30)18-8-6-5-7-9-18/h5-13,28H,4H2,1-3H3,(H,25,29)