2-[3-ethoxy-1-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid

Systemtic Name: 2-[3-ethoxy-1-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid Openeye Name: 2-[3-ethoxy-1-[[4-(2-quinolylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid CAS Name: 2-[3-ethoxy-1-[[4-(2-quinolinylmethoxy)phenyl]methyl]-4-pyrazolyl]propanoic acid IUPAC Name: 2-[3-ethoxy-1-[[4-(quinolin-2-ylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid Traditional Name: 2-[3-ethoxy-1-[4-(2-quinolylmethoxy)benzyl]pyrazol-4-yl]propionic acid Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C=C1C(C)C(=O)O)CC2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC1=NN(C=C1C(C)C(=O)O)CC2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H25N3O4/c1-3-31-24-22(17(2)25(29)30)15-28(27-24)14-18-8-12-21(13-9-18)32-16-20-11-10-19-6-4-5-7-23(19)26-20/h4-13,15,17H,3,14,16H2,1-2H3,(H,29,30)