ethyl 2-cyano-2-[1-(phenylmethyl)pyrimidin-4-ylidene]ethanoate

Systemtic Name: ethyl 2-cyano-2-[1-(phenylmethyl)pyrimidin-4-ylidene]ethanoate Openeye Name: ethyl 2-(1-benzylpyrimidin-4-ylidene)-2-cyano-acetate CAS Name: 2-cyano-2-[1-(phenylmethyl)-4-pyrimidinylidene]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzylpyrimidin-4-ylidene)-2-cyanoacetate Traditional Name: 2-(1-benzylpyrimidin-4-ylidene)-2-cyano-acetic acid ethyl ester Formula: C16H15N3O2 MolecularWeight: 281.3092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C=CN(C=N1)CC2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)C(=C1C=CN(C=N1)CC2=CC=CC=C2)C#N

InChI

InChI=1S/C16H15N3O2/c1-2-21-16(20)14(10-17)15-8-9-19(12-18-15)11-13-6-4-3-5-7-13/h3-9,12H,2,11H2,1H3