3-[5-(bromomethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]propanoic acid

Systemtic Name: 3-[5-(bromomethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]propanoic acid Openeye Name: 3-[5-(bromomethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]propanoic acid CAS Name: 3-[5-(bromomethyl)-2-(4-methoxyphenyl)-3-pyrazolyl]propanoic acid IUPAC Name: 3-[5-(bromomethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]propanoic acid Traditional Name: 3-[5-(bromomethyl)-2-(4-methoxyphenyl)pyrazol-3-yl]propionic acid Formula: C14H15BrN2O3 MolecularWeight: 339.1845

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)CBr)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)CBr)CCC(=O)O

InChI

InChI=1S/C14H15BrN2O3/c1-20-13-5-2-11(3-6-13)17-12(4-7-14(18)19)8-10(9-15)16-17/h2-3,5-6,8H,4,7,9H2,1H3,(H,18,19)