2-(3-bromanyl-4-pyrazol-1-yl-phenyl)propanoic acid

Systemtic Name: 2-(3-bromanyl-4-pyrazol-1-yl-phenyl)propanoic acid Openeye Name: 2-(3-bromo-4-pyrazol-1-yl-phenyl)propanoic acid CAS Name: 2-[3-bromo-4-(1-pyrazolyl)phenyl]propanoic acid IUPAC Name: 2-(3-bromo-4-pyrazol-1-ylphenyl)propanoic acid Traditional Name: 2-(3-bromo-4-pyrazol-1-yl-phenyl)propionic acid Formula: C12H11BrN2O2 MolecularWeight: 295.13194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)N2C=CC=N2)Br)C(=O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)N2C=CC=N2)Br)C(=O)O

InChI

InChI=1S/C12H11BrN2O2/c1-8(12(16)17)9-3-4-11(10(13)7-9)15-6-2-5-14-15/h2-8H,1H3,(H,16,17)