ethyl (2Z)-2-(5-acetyloxy-4-phenyl-1H-pyrimidin-6-ylidene)-2-cyano-ethanoate

Systemtic Name: ethyl (2Z)-2-(5-acetyloxy-4-phenyl-1H-pyrimidin-6-ylidene)-2-cyano-ethanoate Openeye Name: ethyl (2Z)-2-(5-acetoxy-4-phenyl-1H-pyrimidin-6-ylidene)-2-cyano-acetate CAS Name: (2Z)-2-(5-acetyloxy-4-phenyl-1H-pyrimidin-6-ylidene)-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl (2Z)-2-(5-acetyloxy-4-phenyl-1H-pyrimidin-6-ylidene)-2-cyanoacetate Traditional Name: (2Z)-2-(5-acetoxy-4-phenyl-1H-pyrimidin-6-ylidene)-2-cyano-acetic acid ethyl ester Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C(=C(N=CN1)C2=CC=CC=C2)OC(=O)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C\1/C(=C(N=CN1)C2=CC=CC=C2)OC(=O)C)/C#N

InChI

InChI=1S/C17H15N3O4/c1-3-23-17(22)13(9-18)15-16(24-11(2)21)14(19-10-20-15)12-7-5-4-6-8-12/h4-8,10H,3H2,1-2H3,(H,19,20)/b15-13-