methyl 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-[2-cyano-5-(4-pyridylmethoxy)phenoxy]acetate CAS Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]acetate Traditional Name: 2-(2-chlorophenyl)-2-[2-cyano-5-(4-pyridylmethoxy)phenoxy]acetic acid methyl ester Formula: C22H17ClN2O4 MolecularWeight: 408.83438

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1Cl)OC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1Cl)OC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N

InChI

InChI=1S/C22H17ClN2O4/c1-27-22(26)21(18-4-2-3-5-19(18)23)29-20-12-17(7-6-16(20)13-24)28-14-15-8-10-25-11-9-15/h2-12,21H,14H2,1H3