methyl 2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy-3-oxidanylidene-2-phenyl-butanoate

Systemtic Name: methyl 2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy-3-oxidanylidene-2-phenyl-butanoate Openeye Name: methyl 2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy-3-oxo-2-phenyl-butanoate CAS Name: 2-[[6-(2-cyanophenoxy)-4-pyrimidinyl]oxy]-3-oxo-2-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy-3-oxo-2-phenylbutanoate Traditional Name: 2-[6-(2-cyanophenoxy)pyrimidin-4-yl]oxy-3-keto-2-phenyl-butyric acid methyl ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=CC=CC=C1)(C(=O)OC)OC2=NC=NC(=C2)OC3=CC=CC=C3C#N

Isomeric SMILES

CC(=O)C(C1=CC=CC=C1)(C(=O)OC)OC2=NC=NC(=C2)OC3=CC=CC=C3C#N

InChI

InChI=1S/C22H17N3O5/c1-15(26)22(21(27)28-2,17-9-4-3-5-10-17)30-20-12-19(24-14-25-20)29-18-11-7-6-8-16(18)13-23/h3-12,14H,1-2H3