ethyl 2-[[6-(5-cyano-2-methoxy-phenoxy)-2-(3-methylphenoxy)-5-nitro-pyrimidin-4-yl]amino]ethanoate

Systemtic Name: ethyl 2-[[6-(5-cyano-2-methoxy-phenoxy)-2-(3-methylphenoxy)-5-nitro-pyrimidin-4-yl]amino]ethanoate Openeye Name: ethyl 2-[[6-(5-cyano-2-methoxy-phenoxy)-2-(3-methylphenoxy)-5-nitro-pyrimidin-4-yl]amino]acetate CAS Name: 2-[[6-(5-cyano-2-methoxyphenoxy)-2-(3-methylphenoxy)-5-nitro-4-pyrimidinyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[6-(5-cyano-2-methoxyphenoxy)-2-(3-methylphenoxy)-5-nitropyrimidin-4-yl]amino]acetate Traditional Name: 2-[[6-(5-cyano-2-methoxy-phenoxy)-2-(3-methylphenoxy)-5-nitro-pyrimidin-4-yl]amino]acetic acid ethyl ester Formula: C23H21N5O7 MolecularWeight: 479.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC1=C(C(=NC(=N1)OC2=CC=CC(=C2)C)OC3=C(C=CC(=C3)C#N)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CNC1=C(C(=NC(=N1)OC2=CC=CC(=C2)C)OC3=C(C=CC(=C3)C#N)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O7/c1-4-33-19(29)13-25-21-20(28(30)31)22(35-18-11-15(12-24)8-9-17(18)32-3)27-23(26-21)34-16-7-5-6-14(2)10-16/h5-11H,4,13H2,1-3H3,(H,25,26,27)