methyl 2-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-phenyl-ethanoate Openeye Name: methyl 2-[2-cyano-5-(3-thienylmethoxy)phenoxy]-2-phenyl-acetate CAS Name: 2-[2-cyano-5-(3-thiophenylmethoxy)phenoxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-phenylacetate Traditional Name: 2-[2-cyano-5-(3-thenyloxy)phenoxy]-2-phenyl-acetic acid methyl ester Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17NO4S/c1-24-21(23)20(16-5-3-2-4-6-16)26-19-11-18(8-7-17(19)12-22)25-13-15-9-10-27-14-15/h2-11,14,20H,13H2,1H3