2-[2-(1-phenylpyrazol-4-yl)carbonyl-4-propan-2-yloxy-phenoxy]ethanoic acid

Systemtic Name: 2-[2-(1-phenylpyrazol-4-yl)carbonyl-4-propan-2-yloxy-phenoxy]ethanoic acid Openeye Name: 2-[4-isopropoxy-2-(1-phenylpyrazole-4-carbonyl)phenoxy]acetic acid CAS Name: 2-[2-[oxo-(1-phenyl-4-pyrazolyl)methyl]-4-propan-2-yloxyphenoxy]acetic acid IUPAC Name: 2-[2-(1-phenylpyrazole-4-carbonyl)-4-propan-2-yloxyphenoxy]acetic acid Traditional Name: 2-[4-isopropoxy-2-(1-phenylpyrazole-4-carbonyl)phenoxy]acetic acid Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)OCC(=O)O)C(=O)C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)OCC(=O)O)C(=O)C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O5/c1-14(2)28-17-8-9-19(27-13-20(24)25)18(10-17)21(26)15-11-22-23(12-15)16-6-4-3-5-7-16/h3-12,14H,13H2,1-2H3,(H,24,25)