2-[(4-cyano-3-fluoranyl-phenyl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)ethanoic acid

Systemtic Name: 2-[(4-cyano-3-fluoranyl-phenyl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)ethanoic acid Openeye Name: 2-(4-cyano-3-fluoro-anilino)-2-(3-ethoxy-4-isopropoxy-phenyl)acetic acid CAS Name: 2-(4-cyano-3-fluoroanilino)-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetic acid IUPAC Name: 2-(4-cyano-3-fluoroanilino)-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetic acid Traditional Name: 2-(4-cyano-3-fluoro-anilino)-2-(3-ethoxy-4-isopropoxy-phenyl)acetic acid Formula: C20H21FN2O4 MolecularWeight: 372.390143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)O)NC2=CC(=C(C=C2)C#N)F)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C(=O)O)NC2=CC(=C(C=C2)C#N)F)OC(C)C

InChI

InChI=1S/C20H21FN2O4/c1-4-26-18-9-13(6-8-17(18)27-12(2)3)19(20(24)25)23-15-7-5-14(11-22)16(21)10-15/h5-10,12,19,23H,4H2,1-3H3,(H,24,25)