3-butan-2-yloxy-2-(1H-pyrazol-4-yl)-3-(quinolin-2-ylmethoxy)propanoic acid

Systemtic Name: 3-butan-2-yloxy-2-(1H-pyrazol-4-yl)-3-(quinolin-2-ylmethoxy)propanoic acid Openeye Name: 2-(1H-pyrazol-4-yl)-3-(2-quinolylmethoxy)-3-sec-butoxy-propanoic acid CAS Name: 3-butan-2-yloxy-2-(1H-pyrazol-4-yl)-3-(2-quinolinylmethoxy)propanoic acid IUPAC Name: 3-butan-2-yloxy-2-(1H-pyrazol-4-yl)-3-(quinolin-2-ylmethoxy)propanoic acid Traditional Name: 2-(1H-pyrazol-4-yl)-3-(2-quinolylmethoxy)-3-sec-butoxy-propionic acid Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(C(C1=CNN=C1)C(=O)O)OCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC(C)OC(C(C1=CNN=C1)C(=O)O)OCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H23N3O4/c1-3-13(2)27-20(18(19(24)25)15-10-21-22-11-15)26-12-16-9-8-14-6-4-5-7-17(14)23-16/h4-11,13,18,20H,3,12H2,1-2H3,(H,21,22)(H,24,25)