2-fluoranyl-2-propan-2-yloxy-3-[3-(quinolin-3-ylmethoxycarbonylamino)phenyl]propanoic acid

Systemtic Name: 2-fluoranyl-2-propan-2-yloxy-3-[3-(quinolin-3-ylmethoxycarbonylamino)phenyl]propanoic acid Openeye Name: 2-fluoro-2-isopropoxy-3-[3-(3-quinolylmethoxycarbonylamino)phenyl]propanoic acid CAS Name: 2-fluoro-3-[3-[[oxo(3-quinolinylmethoxy)methyl]amino]phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 2-fluoro-2-propan-2-yloxy-3-[3-(quinolin-3-ylmethoxycarbonylamino)phenyl]propanoic acid Traditional Name: 2-fluoro-2-isopropoxy-3-[3-(3-quinolylmethoxycarbonylamino)phenyl]propionic acid Formula: C23H23FN2O5 MolecularWeight: 426.437523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(CC1=CC(=CC=C1)NC(=O)OCC2=CC3=CC=CC=C3N=C2)(C(=O)O)F

Isomeric SMILES

CC(C)OC(CC1=CC(=CC=C1)NC(=O)OCC2=CC3=CC=CC=C3N=C2)(C(=O)O)F

InChI

InChI=1S/C23H23FN2O5/c1-15(2)31-23(24,21(27)28)12-16-6-5-8-19(11-16)26-22(29)30-14-17-10-18-7-3-4-9-20(18)25-13-17/h3-11,13,15H,12,14H2,1-2H3,(H,26,29)(H,27,28)