2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]-2-(3-methylthiophen-2-yl)ethanoic acid

Systemtic Name: 2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]-2-(3-methylthiophen-2-yl)ethanoic acid Openeye Name: 2-[2-cyano-5-(4-pyridylmethoxy)phenoxy]-2-(3-methyl-2-thienyl)acetic acid CAS Name: 2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]-2-(3-methyl-2-thiophenyl)acetic acid IUPAC Name: 2-[2-cyano-5-(pyridin-4-ylmethoxy)phenoxy]-2-(3-methylthiophen-2-yl)acetic acid Traditional Name: 2-[2-cyano-5-(4-pyridylmethoxy)phenoxy]-2-(3-methyl-2-thienyl)acetic acid Formula: C20H16N2O4S MolecularWeight: 380.41704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C(=O)O)OC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N

Isomeric SMILES

CC1=C(SC=C1)C(C(=O)O)OC2=C(C=CC(=C2)OCC3=CC=NC=C3)C#N

InChI

InChI=1S/C20H16N2O4S/c1-13-6-9-27-19(13)18(20(23)24)26-17-10-16(3-2-15(17)11-21)25-12-14-4-7-22-8-5-14/h2-10,18H,12H2,1H3,(H,23,24)