2-[4-bromanyl-2-(1-phenylpyrazol-4-yl)carbonyl-phenoxy]propanoic acid

Systemtic Name: 2-[4-bromanyl-2-(1-phenylpyrazol-4-yl)carbonyl-phenoxy]propanoic acid Openeye Name: 2-[4-bromo-2-(1-phenylpyrazole-4-carbonyl)phenoxy]propanoic acid CAS Name: 2-[4-bromo-2-[oxo-(1-phenyl-4-pyrazolyl)methyl]phenoxy]propanoic acid IUPAC Name: 2-[4-bromo-2-(1-phenylpyrazole-4-carbonyl)phenoxy]propanoic acid Traditional Name: 2-[4-bromo-2-(1-phenylpyrazole-4-carbonyl)phenoxy]propionic acid Formula: C19H15BrN2O4 MolecularWeight: 415.2374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15BrN2O4/c1-12(19(24)25)26-17-8-7-14(20)9-16(17)18(23)13-10-21-22(11-13)15-5-3-2-4-6-15/h2-12H,1H3,(H,24,25)