2-[[3-cyano-2-[4-(2-ethoxyphenyl)phenyl]-6-fluoranyl-quinolin-4-yl]-phenyl-amino]ethanoic acid

Systemtic Name: 2-[[3-cyano-2-[4-(2-ethoxyphenyl)phenyl]-6-fluoranyl-quinolin-4-yl]-phenyl-amino]ethanoic acid Openeye Name: 2-(N-[3-cyano-2-[4-(2-ethoxyphenyl)phenyl]-6-fluoro-4-quinolyl]anilino)acetic acid CAS Name: 2-(N-[3-cyano-2-[4-(2-ethoxyphenyl)phenyl]-6-fluoro-4-quinolinyl]anilino)acetic acid IUPAC Name: 2-(N-[3-cyano-2-[4-(2-ethoxyphenyl)phenyl]-6-fluoroquinolin-4-yl]anilino)acetic acid Traditional Name: 2-(N-[3-cyano-6-fluoro-2-(4-o-phenetylphenyl)-4-quinolyl]anilino)acetic acid Formula: C32H24FN3O3 MolecularWeight: 517.549663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)F)C(=C3C#N)N(CC(=O)O)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)F)C(=C3C#N)N(CC(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C32H24FN3O3/c1-2-39-29-11-7-6-10-25(29)21-12-14-22(15-13-21)31-27(19-34)32(26-18-23(33)16-17-28(26)35-31)36(20-30(37)38)24-8-4-3-5-9-24/h3-18H,2,20H2,1H3,(H,37,38)